Massbank MS database records for Caffeine
Massbank ID | Instrument | Inst. type | Collision energy | Ion type | Ion mode | MS level |
---|---|---|---|---|---|---|
MSBNK-Washington_State_Univ-BML00696 | Agilent 1200 RRLC; Agilent 652... | LC-ESI-QTOF | 10 ev | [M+H]+ | POSITIVE | MS2 |
MSBNK-Washington_State_Univ-BML00705 | Agilent 1200 RRLC; Agilent 652... | LC-ESI-QTOF | 20 ev | [M+H]+ | POSITIVE | MS2 |
MSBNK-Washington_State_Univ-BML00714 | Agilent 1200 RRLC; Agilent 652... | LC-ESI-QTOF | 40 ev | [M+H]+ | POSITIVE | MS2 |
MSBNK-Washington_State_Univ-BML80860 | Agilent 1200 RRLC; Agilent 652... | LC-ESI-QTOF | - | - | POSITIVE | MS |
MSBNK-Washington_State_Univ-BML80862 | Agilent 1200 RRLC; Agilent 652... | LC-APCI-QTOF | - | - | POSITIVE | MS |
MSBNK-Keio_Univ-KO002537 | API3000, Applied Biosystems | LC-ESI-QQ | 10 V | [M+H]+ | POSITIVE | MS2 |
MSBNK-Keio_Univ-KO002538 | API3000, Applied Biosystems | LC-ESI-QQ | 20 V | [M+H]+ | POSITIVE | MS2 |
MSBNK-Keio_Univ-KO002539 | API3000, Applied Biosystems | LC-ESI-QQ | 30 V | [M+H]+ | POSITIVE | MS2 |
MSBNK-Keio_Univ-KO002540 | API3000, Applied Biosystems | LC-ESI-QQ | 40 V | [M+H]+ | POSITIVE | MS2 |
MSBNK-Keio_Univ-KO002541 | API3000, Applied Biosystems | LC-ESI-QQ | 50 V | [M+H]+ | POSITIVE | MS2 |
MSBNK-Athens_Univ-AU276601 | Bruker maXis Impact | LC-ESI-QTOF | 10 eV | [M+H]+ | POSITIVE | MS2 |
MSBNK-Athens_Univ-AU276602 | Bruker maXis Impact | LC-ESI-QTOF | 20 eV | [M+H]+ | POSITIVE | MS2 |
MSBNK-Athens_Univ-AU276603 | Bruker maXis Impact | LC-ESI-QTOF | 30 eV | [M+H]+ | POSITIVE | MS2 |
MSBNK-Athens_Univ-AU276606 | Bruker maXis Impact | LC-ESI-QTOF | Ramp 14.5-21.8 eV | [M+H]+ | POSITIVE | MS2 |
MSBNK-Fac_Eng_Univ_Tokyo-JP003477 | HITACHI M-60 | EI-B | - | - | POSITIVE | MS |
MSBNK-Fac_Eng_Univ_Tokyo-JP003788 | HITACHI M-60 | CI-B | - | - | POSITIVE | MS |
MSBNK-Fac_Eng_Univ_Tokyo-JP003511 | HITACHI M-68 | EI-B | - | - | POSITIVE | MS |
MSBNK-Fac_Eng_Univ_Tokyo-JP000558 | HITACHI M-80 | EI-B | - | - | POSITIVE | MS |
MSBNK-JEOL_Ltd-JEL00040 | JMS-S3000 | MALDI-TOFTOF | - | - | POSITIVE | MS2 |
MSBNK-Eawag-EA030302 | LTQ Orbitrap XL Thermo Scienti... | LC-ESI-ITFT | 15 % (nominal) | [M+H]+ | POSITIVE | MS2 |
MSBNK-Eawag-EA030308 | LTQ Orbitrap XL Thermo Scienti... | LC-ESI-ITFT | 15 % (nominal) | [M+H]+ | POSITIVE | MS2 |
MSBNK-Eawag-EA030303 | LTQ Orbitrap XL Thermo Scienti... | LC-ESI-ITFT | 30 % (nominal) | [M+H]+ | POSITIVE | MS2 |
MSBNK-Eawag-EA030309 | LTQ Orbitrap XL Thermo Scienti... | LC-ESI-ITFT | 30 % (nominal) | [M+H]+ | POSITIVE | MS2 |
MSBNK-UFZ-UF408903 | LTQ Orbitrap XL Thermo Scienti... | LC-ESI-ITFT | 35 (nominal) | [M+H]+ | POSITIVE | MS2 |
MSBNK-Eawag-EA030301 | LTQ Orbitrap XL Thermo Scienti... | LC-ESI-ITFT | 35 % (nominal) | [M+H]+ | POSITIVE | MS2 |
MSBNK-Eawag-EA030314 | LTQ Orbitrap XL Thermo Scienti... | LC-ESI-ITFT | 35 % (nominal) | [M+H]+ | POSITIVE | MS2 |
MSBNK-UFZ-UA005001 | LTQ Orbitrap XL Thermo Scienti... | ESI-ITFT | 35 % (nominal) | [M+H]+ | POSITIVE | MS2 |
MSBNK-UFZ-UA005003 | LTQ Orbitrap XL Thermo Scienti... | APCI-ITFT | 35 % (nominal) | [M+H]+ | POSITIVE | MS2 |
MSBNK-Eawag-EA030304 | LTQ Orbitrap XL Thermo Scienti... | LC-ESI-ITFT | 45 % (nominal) | [M+H]+ | POSITIVE | MS2 |
MSBNK-Eawag-EA030310 | LTQ Orbitrap XL Thermo Scienti... | LC-ESI-ITFT | 45 % (nominal) | [M+H]+ | POSITIVE | MS2 |
MSBNK-UFZ-UF408901 | LTQ Orbitrap XL Thermo Scienti... | LC-ESI-ITFT | 55 (nominal) | [M+H]+ | POSITIVE | MS2 |
MSBNK-UFZ-UF408904 | LTQ Orbitrap XL Thermo Scienti... | LC-ESI-ITFT | 55 (nominal) | [M+H]+ | POSITIVE | MS2 |
MSBNK-Eawag-EA030305 | LTQ Orbitrap XL Thermo Scienti... | LC-ESI-ITFT | 60 % (nominal) | [M+H]+ | POSITIVE | MS2 |
MSBNK-Eawag-EA030311 | LTQ Orbitrap XL Thermo Scienti... | LC-ESI-ITFT | 60 % (nominal) | [M+H]+ | POSITIVE | MS2 |
MSBNK-Eawag-EA030306 | LTQ Orbitrap XL Thermo Scienti... | LC-ESI-ITFT | 75 % (nominal) | [M+H]+ | POSITIVE | MS2 |
MSBNK-Eawag-EA030312 | LTQ Orbitrap XL Thermo Scienti... | LC-ESI-ITFT | 75 % (nominal) | [M+H]+ | POSITIVE | MS2 |
MSBNK-UFZ-UF408902 | LTQ Orbitrap XL Thermo Scienti... | LC-ESI-ITFT | 80 (nominal) | [M+H]+ | POSITIVE | MS2 |
MSBNK-Eawag-EA030307 | LTQ Orbitrap XL Thermo Scienti... | LC-ESI-ITFT | 90 % (nominal) | [M+H]+ | POSITIVE | MS2 |
MSBNK-Eawag-EA030313 | LTQ Orbitrap XL Thermo Scienti... | LC-ESI-ITFT | 90 % (nominal) | [M+H]+ | POSITIVE | MS2 |
MSBNK-Metabolon-MT000087 | LTQ XL, Thermo Finnigan | LC-ESI-IT | 40 | [M+H]+ | POSITIVE | MS2 |
MSBNK-Fiocruz-FIO00568 | maXis (Bruker Daltonics) | LC-ESI-QTOF | 10 eV | [M+H]+ | POSITIVE | MS2 |
MSBNK-Fiocruz-FIO00569 | maXis (Bruker Daltonics) | LC-ESI-QTOF | 20 eV | [M+H]+ | POSITIVE | MS2 |
MSBNK-Fiocruz-FIO00570 | maXis (Bruker Daltonics) | LC-ESI-QTOF | 30 eV | [M+H]+ | POSITIVE | MS2 |
MSBNK-Fiocruz-FIO00571 | maXis (Bruker Daltonics) | LC-ESI-QTOF | 40 eV | [M+H]+ | POSITIVE | MS2 |
MSBNK-Fiocruz-FIO00572 | maXis (Bruker Daltonics) | LC-ESI-QTOF | 50 eV | [M+H]+ | POSITIVE | MS2 |
MSBNK-KWR-KW107902 | Orbitrap Classic, Thermo Scien... | LC-ESI-ITFT | 35 eV FT-MS | [M+H]+ | POSITIVE | MS2 |
MSBNK-KWR-KW107903 | Orbitrap Classic, Thermo Scien... | LC-ESI-ITFT | 35 eV FT-MS II | [M+H]+ | POSITIVE | MS2 |
MSBNK-KWR-KW107901 | Orbitrap Classic, Thermo Scien... | LC-ESI-ITFT | 35 eV IT-MS | [M+H]+ | POSITIVE | MS2 |
MSBNK-KWR-KW107904 | Orbitrap Classic, Thermo Scien... | LC-ESI-ITFT | 65 eV FT-MS | [M+H]+ | POSITIVE | MS2 |
MSBNK-Kazusa-KZ000017 | Pegasus III TOF-MS system, Lec... | GC-EI-TOF | - | - | POSITIVE | MS |
MSBNK-Kazusa-KZ000113 | Pegasus III TOF-MS system, Lec... | GC-EI-TOF | - | - | POSITIVE | MS |
MSBNK-Osaka_Univ-OUF00133 | Pegasus III TOF-MS system, Lec... | GC-EI-TOF | - | - | POSITIVE | MS |
MSBNK-RIKEN-PR010011 | Pegasus III TOF-MS system, Lec... | GC-EI-TOF | - | - | POSITIVE | MS |
MSBNK-ACES_SU-AS000088 | QExactive Orbitrap HF-X (Therm... | LC-APCI-QFT | Ramp 20%-70% (nominal) | - | POSITIVE | MS2 |
MSBNK-ACES_SU-AS000159 | QExactive Orbitrap HF-X (Therm... | LC-ESI-QFT | Ramp 20%-70% (nominal) | - | POSITIVE | MS2 |
MSBNK-LCSB-LU119901 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | 15 | [M+H]+ | POSITIVE | MS2 |
MSBNK-LCSB-LU119902 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | 30 | [M+H]+ | POSITIVE | MS2 |
MSBNK-LCSB-LU119903 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | 45 | [M+H]+ | POSITIVE | MS2 |
MSBNK-LCSB-LU119904 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | 60 | [M+H]+ | POSITIVE | MS2 |
MSBNK-LCSB-LU119905 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | 75 | [M+H]+ | POSITIVE | MS2 |
MSBNK-LCSB-LU119906 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | 90 | [M+H]+ | POSITIVE | MS2 |
MSBNK-CASMI_2016-SM866601 | Q Exactive Plus Orbitrap Therm... | LC-ESI-QFT | 35 (nominal) | [M+H]+ | POSITIVE | MS2 |
MSBNK-RIKEN_ReSpect-PT100453 | Q-Tof Premier, Waters | LC-ESI-QTOF | 30 V | - | POSITIVE | MS2 |
MSBNK-RIKEN_ReSpect-PT100450 | Q-Tof Premier, Waters | LC-ESI-QTOF | Ramp 5-45 V | - | POSITIVE | MS2 |
MSBNK-RIKEN_ReSpect-PS004501 | TQD, Waters | LC-ESI-QQ | 10 | - | POSITIVE | MS2 |
MSBNK-RIKEN_ReSpect-PS004502 | TQD, Waters | LC-ESI-QQ | 20 | - | POSITIVE | MS2 |
MSBNK-RIKEN_ReSpect-PS004503 | TQD, Waters | LC-ESI-QQ | 30 | - | POSITIVE | MS2 |
MSBNK-RIKEN_ReSpect-PS004504 | TQD, Waters | LC-ESI-QQ | 40 | - | POSITIVE | MS2 |
MSBNK-RIKEN_ReSpect-PS004505 | TQD, Waters | LC-ESI-QQ | 50 | - | POSITIVE | MS2 |
MSBNK-RIKEN_ReSpect-PS004506 | TQD, Waters | LC-ESI-QQ | 60 | - | POSITIVE | MS2 |
MSBNK-BAFG-CSL2311094664 | TripleTOF 5600 SCIEX | LC-ESI-QTOF | 10 | [M+H]+ | POSITIVE | MS2 |
MSBNK-BAFG-CSL2311094658 | TripleTOF 5600 SCIEX | LC-ESI-QTOF | 100 | [M+H]+ | POSITIVE | MS2 |
MSBNK-BAFG-CSL2311094665 | TripleTOF 5600 SCIEX | LC-ESI-QTOF | 110 | [M+H]+ | POSITIVE | MS2 |
MSBNK-BAFG-CSL2311094668 | TripleTOF 5600 SCIEX | LC-ESI-QTOF | 120 | [M+H]+ | POSITIVE | MS2 |
MSBNK-BAFG-CSL2311094659 | TripleTOF 5600 SCIEX | LC-ESI-QTOF | 130 | [M+H]+ | POSITIVE | MS2 |
MSBNK-BAFG-CSL2311094656 | TripleTOF 5600 SCIEX | LC-ESI-QTOF | 140 | [M+H]+ | POSITIVE | MS2 |
MSBNK-BAFG-CSL2311094667 | TripleTOF 5600 SCIEX | LC-ESI-QTOF | 150 | [M+H]+ | POSITIVE | MS2 |
MSBNK-BAFG-CSL2311094666 | TripleTOF 5600 SCIEX | LC-ESI-QTOF | 20 | [M+H]+ | POSITIVE | MS2 |
MSBNK-BAFG-CSL2311094669 | TripleTOF 5600 SCIEX | LC-ESI-QTOF | 30 | [M+H]+ | POSITIVE | MS2 |
MSBNK-BAFG-CSL2311094657 | TripleTOF 5600 SCIEX | LC-ESI-QTOF | 40 | [M+H]+ | POSITIVE | MS2 |
MSBNK-BAFG-CSL2311094663 | TripleTOF 5600 SCIEX | LC-ESI-QTOF | 40 | [M+H]+ | POSITIVE | MS2 |
MSBNK-BAFG-CSL2311094671 | TripleTOF 5600 SCIEX | LC-ESI-QTOF | 50 | [M+H]+ | POSITIVE | MS2 |
MSBNK-BAFG-CSL2311094661 | TripleTOF 5600 SCIEX | LC-ESI-QTOF | 60 | [M+H]+ | POSITIVE | MS2 |
MSBNK-BAFG-CSL2311094662 | TripleTOF 5600 SCIEX | LC-ESI-QTOF | 70 | [M+H]+ | POSITIVE | MS2 |
MSBNK-BAFG-CSL2311094660 | TripleTOF 5600 SCIEX | LC-ESI-QTOF | 80 | [M+H]+ | POSITIVE | MS2 |
MSBNK-BAFG-CSL2311094670 | TripleTOF 5600 SCIEX | LC-ESI-QTOF | 90 | [M+H]+ | POSITIVE | MS2 |
MSBNK-IPB_Halle-PB003781 | TSQ 7000 | LC-ESI-QQ | 25 eV | [M+H]+ | POSITIVE | MS2 |
MSBNK-IPB_Halle-PB003782 | TSQ 7000 | LC-ESI-QQ | 30 eV | [M+H]+ | POSITIVE | MS2 |
MSBNK-IPB_Halle-PB003783 | TSQ 7000 | LC-ESI-QQ | 35 eV | [M+H]+ | POSITIVE | MS2 |
MSBNK-Fac_Eng_Univ_Tokyo-JP003158 | Unknown | CI-B | - | - | POSITIVE | MS |
MSBNK-RIKEN-PR100026 | UPLC Q-Tof Premier, Waters | LC-ESI-QTOF | 30 V | [M+H]+ | POSITIVE | MS2 |
MSBNK-RIKEN-PR100025 | UPLC Q-Tof Premier, Waters | LC-ESI-QTOF | Ramp 5-60 V | [M+H]+ | POSITIVE | MS2 |
MSBNK-Waters-WA000948 | ZQ, Waters | LC-ESI-Q | - | - | POSITIVE | MS |
MSBNK-Waters-WA000949 | ZQ, Waters | LC-ESI-Q | - | - | POSITIVE | MS |
MSBNK-Waters-WA000950 | ZQ, Waters | LC-ESI-Q | - | - | POSITIVE | MS |
MSBNK-Waters-WA000951 | ZQ, Waters | LC-ESI-Q | - | - | POSITIVE | MS |
MSBNK-Waters-WA000952 | ZQ, Waters | LC-ESI-Q | - | - | POSITIVE | MS |