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2-Phenyl-4-pentynoic acid

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2-Phenyl-4-pentynoic acid
SpectraBase Compound ID K4XrFJFFXZX
InChI InChI=1S/C11H10O2/c1-2-6-10(11(12)13)9-7-4-3-5-8-9/h1,3-5,7-8,10H,6H2,(H,12,13)
InChIKey HLLOQKAJNPXKKB-UHFFFAOYSA-N
Mol Weight 174.2 g/mol
Molecular Formula C11H10O2
Exact Mass 174.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L4Bhvka039n
Name 2-Phenyl-4-pentynoic acid
CAS Registry Number 51632-38-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10O2
InChI InChI=1S/C11H10O2/c1-2-6-10(11(12)13)9-7-4-3-5-8-9/h1,3-5,7-8,10H,6H2,(H,12,13)
InChIKey HLLOQKAJNPXKKB-UHFFFAOYSA-N
Molecular Weight 174.199 g/mol
SMILES OC(C(c1ccccc1)CC#C)=O
SPLASH splash10-0002-9000000000-2478077cbcd43a4bcbbb
Source of Spectrum C-103-5464-0
Synonyms 2-Phenylpent-4-ynoic acid
Wiley ID 1170816