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3-[(2E)-2-ethylidenecyclohexyl]propanoic acid

View entire compound with spectra: 1 MS (GC)

3-[(2E)-2-ethylidenecyclohexyl]propanoic acid
SpectraBase Compound ID 4i3Fy07NJzX
InChI InChI=1S/C11H18O2/c1-2-9-5-3-4-6-10(9)7-8-11(12)13/h2,10H,3-8H2,1H3,(H,12,13)/b9-2+
InChIKey LLWPPOZTMRJESK-XNWCZRBMSA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AgUBXxrG6ZG
Name 3-[(2E)-2-ethylidenecyclohexyl]propanoic acid
CAS Registry Number 96165-22-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-2-9-5-3-4-6-10(9)7-8-11(12)13/h2,10H,3-8H2,1H3,(H,12,13)/b9-2+
InChIKey LLWPPOZTMRJESK-XNWCZRBMSA-N
Molecular Weight 182.263 g/mol
SMILES OC(CCC1\C(=C\C)CCCC1)=O
SPLASH splash10-00e9-0900000000-6b18a528396f24702169
Source of Spectrum J-50-1995-0
Wiley ID 1178827