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trans-2-HEPTENOIC ACID, METHYL ESTER
SpectraBase Compound ID A5oRo14SZvK
InChI InChI=1S/C8H14O2/c1-3-4-5-6-7-8(9)10-2/h6-7H,3-5H2,1-2H3/b7-6+
InChIKey IQQDLHGWGKEQDS-VOTSOKGWSA-N
Mol Weight 142.2 g/mol
Molecular Formula C8H14O2
Exact Mass 142.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CvnE3qGym2d
Name 2-Heptenoic acid, methyl ester
Alternate Name(s) 2-Heptenoic acid, methyl ester, (E)- (E)-hept-2-enoic acid methyl ester Methyl (2E)-2-heptenoate Methyl (2Z)-2-heptenoate Methyl (E)-hept-2-enoate Methyl trans-2-heptenoate
CAS Registry Number 22104-69-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O2
InChI InChI=1S/C8H14O2/c1-3-4-5-6-7-8(9)10-2/h6-7H,3-5H2,1-2H3/b7-6+
InChIKey IQQDLHGWGKEQDS-VOTSOKGWSA-N
Molecular Weight 142.198 g/mol
SMILES CCCC\C=C\C(OC)=O
SPLASH splash10-06vu-9100000000-737a569225c8b6f8b9e7
Source of Spectrum VC-1981-849-0
Wiley ID 1140946