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(E)-2-Methyl-3-phenylhept-2-enoic acid

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

(E)-2-Methyl-3-phenylhept-2-enoic acid
SpectraBase Compound ID 3eQfAIOYO7H
InChI InChI=1S/C14H18O2/c1-3-4-10-13(11(2)14(15)16)12-8-6-5-7-9-12/h5-9H,3-4,10H2,1-2H3,(H,15,16)/b13-11+
InChIKey VKFCTVITDYVIMR-ACCUITESSA-N
Mol Weight 218.3 g/mol
Molecular Formula C14H18O2
Exact Mass 218.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ZkLu3HUZyP
Name (E)-2-Methyl-3-phenylhept-2-enoic acid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O2
InChI InChI=1S/C14H18O2/c1-3-4-10-13(11(2)14(15)16)12-8-6-5-7-9-12/h5-9H,3-4,10H2,1-2H3,(H,15,16)/b13-11+
InChIKey VKFCTVITDYVIMR-ACCUITESSA-N
Literature Reference DOI 10.1002/anie.201305218
Molecular Weight 218.296 g/mol
SMILES OC(\C(=C/(CCCC)c1ccccc1)C)=O
SPLASH splash10-016r-1940000000-02fffdf1482e03c769df
Source of Spectrum ACI-52-SM6-A2
Wiley ID 1781842