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3-Hexenoic acid, methyl ester
SpectraBase Compound ID Aw7lakni9Dr
InChI InChI=1S/C7H12O2/c1-3-4-5-6-7(8)9-2/h4-5H,3,6H2,1-2H3/b5-4+
InChIKey XEAIHUDTEINXFG-SNAWJCMRSA-N
Mol Weight 128.17 g/mol
Molecular Formula C7H12O2
Exact Mass 128.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5qdu2QMEs9z
Name 3-Hexenoic acid, methyl ester
Alternate Name(s) Methyl (3E)-3-hexenoate (E)-3-hexenoic acid methyl ester (E)-hex-3-enoic acid methyl ester 3-Hexenoic acid, methyl ester, (E)- 3-Hexenoic acid, methyl ester, (3E)- Methyl (E)-3-hexenoate Methyl (E)-hex-3-enoate Methyl 3-hexenoate Methyl hex-3-enoate Methyl hydrosorbate Methyl trans-3-hexenoate EINECS 219-256-1 EINECS 237-662-7 FEMA NO. 3364
CAS Registry Number 2396-78-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O2
InChI InChI=1S/C7H12O2/c1-3-4-5-6-7(8)9-2/h4-5H,3,6H2,1-2H3/b5-4+
InChIKey XEAIHUDTEINXFG-SNAWJCMRSA-N
Molecular Weight 128.171 g/mol
SMILES C(C(=O)OC)\C=C\CC
SPLASH splash10-01bc-9000000000-b81473d6700173e5ba04
Source of Spectrum JZ-1992-4172-0
Wiley ID 1131152