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Hexanoic acid, 2-butenyl ester

View entire compound with spectra: 2 MS (GC)

Hexanoic acid, 2-butenyl ester
SpectraBase Compound ID LWwghWxKzGI
InChI InChI=1S/C10H18O2/c1-3-5-7-8-10(11)12-9-6-4-2/h4,6H,3,5,7-9H2,1-2H3/b6-4+
InChIKey GVNVILDVKWMWLW-GQCTYLIASA-N
Mol Weight 170.25 g/mol
Molecular Formula C10H18O2
Exact Mass 170.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BB0w45fRx38
Name Hexanoic acid, 2-butenyl ester
Alternate Name(s) (2E)-2-Butenyl hexanoate [(E)-but-2-enyl] hexanoate
CAS Registry Number 94291-54-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O2
InChI InChI=1S/C10H18O2/c1-3-5-7-8-10(11)12-9-6-4-2/h4,6H,3,5,7-9H2,1-2H3/b6-4+
InChIKey GVNVILDVKWMWLW-GQCTYLIASA-N
Molecular Weight 170.252 g/mol
SMILES CCCCCC(=O)OC\C=C\C
SPLASH splash10-05be-9000000000-41dc224849df5637e9f1
Wiley ID 1495552