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beta-butylhydrocinnamic acid
SpectraBase Compound ID HlfahQ2mqiJ
InChI InChI=1S/C13H18O2/c1-2-3-7-12(10-13(14)15)11-8-5-4-6-9-11/h4-6,8-9,12H,2-3,7,10H2,1H3,(H,14,15)
InChIKey YEUNYNJOKMJRMC-UHFFFAOYSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BbObQvRXyua
Name 3-PHENYLHEPTANOIC ACID
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-2-3-7-12(10-13(14)15)11-8-5-4-6-9-11/h4-6,8-9,12H,2-3,7,10H2,1H3,(H,14,15)
InChIKey YEUNYNJOKMJRMC-UHFFFAOYSA-N
Molecular Weight 206.1302
SMILES OC(=O)CC(CCCC)c1ccccc1
SPLASH splash10-0a4m-6900000000-9cb280a32045e202f717
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany