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3-Octenoic acid, 2-pentylidene-, methyl ester, (Z,E)-
SpectraBase Compound ID FdqVQgNULSD
InChI InChI=1S/C14H24O2/c1-4-6-8-10-12-13(14(15)16-3)11-9-7-5-2/h10-12H,4-9H2,1-3H3/b12-10+,13-11-
InChIKey WYEIJAAZKCNKHZ-FAEGWCMCSA-N
Mol Weight 224.34 g/mol
Molecular Formula C14H24O2
Exact Mass 224.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6svrHjJBrjw
Name 3-Octenoic acid, 2-pentylidene-, methyl ester, (Z,E)-
Alternate Name(s) (Z,E)-1-Butyl-2-(2'-butylethenyl)-2-methoxycarbonylethene Methyl (2Z,3E)-2-pentylidene-3-octenoate
CAS Registry Number 112151-71-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H24O2
InChI InChI=1S/C14H24O2/c1-4-6-8-10-12-13(14(15)16-3)11-9-7-5-2/h10-12H,4-9H2,1-3H3/b12-10+,13-11-
InChIKey WYEIJAAZKCNKHZ-FAEGWCMCSA-N
Molecular Weight 224.344 g/mol
SMILES C(\C(\C=C\CCCC)=C/CCCC)(=O)OC
SPLASH splash10-00fr-0890000000-0bdd4cf35f2efe95ee4e
Source of Spectrum J-53-609-0
Wiley ID 1225652