Metabolomics Structure Database

 
MW REGNO: 4736
Common Name:2E-Hexene
Systematic Name:2E-Hexene
RefMet Name:2E-Hexene
Synonyms: [PubChem Synonyms]
Exact Mass:
84.0939 (neutral)    Calculate m/z:
Formula:C6H12
InChIKey:RYPKRALMXUUNKS-HWKANZROSA-N
LIPID MAPS Category:Fatty Acyls [FA]
LIPID MAPS mainclass:Hydrocarbons [FA11]
Massbank MS spectra:View MS spectra
SMILES:C/C=C/CCC
Studies:Available studies (via RefMet name)

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References

LIPID MAPS classification: "Update of the LIPID MAPS comprehensive classification system for lipids", Fahy E, Subramaniam S, Murphy RC, Nishijima M, Raetz CR, Shimizu T, Spener F, van Meer G, Wakelam MJ, and Dennis EA, J. Lipid Res. (2009) 50: S9-S14. DOI: 10.1194/jlr.R800095-JLR200
ClassyFire classification: "ClassyFire: automated chemical classification with a comprehensive, computable taxonomy", Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS, J. Cheminformatics (2016) 8:61. DOI: 10.1186/s13321-016-0174-y

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