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trans-5,5-diphenyl-3-hexenoic acid
SpectraBase Compound ID 1RJE9NKEjI4
InChI InChI=1S/C18H18O2/c1-18(14-8-13-17(19)20,15-9-4-2-5-10-15)16-11-6-3-7-12-16/h2-12,14H,13H2,1H3,(H,19,20)/b14-8+
InChIKey WQTUJTVDWNQBCF-RIYZIHGNSA-N
Mol Weight 266.34 g/mol
Molecular Formula C18H18O2
Exact Mass 266.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2khD4TTXWB
Name trans-5,5-diphenyl-3-hexenoic acid
Alternate Name(s) (3E)-5,5-diphenyl-3-hexenoic acid
CAS Registry Number 119296-99-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O2
InChI InChI=1S/C18H18O2/c1-18(14-8-13-17(19)20,15-9-4-2-5-10-15)16-11-6-3-7-12-16/h2-12,14H,13H2,1H3,(H,19,20)/b14-8+
InChIKey WQTUJTVDWNQBCF-RIYZIHGNSA-N
Molecular Weight 266.340 g/mol
SMILES OC(C\C=C\C(c1ccccc1)(c1ccccc1)C)=O
SPLASH splash10-0a4l-3970000000-956ed437a7329885a89f
Source of Spectrum J-54-1679-43
Wiley ID 1270630