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Phenylacetic acid-1-13C
SpectraBase Compound ID Lg1ICVTID4k
InChI InChI=1S/C8H8O2/c9-8(10)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,9,10)/i8+1
InChIKey WLJVXDMOQOGPHL-VJJZLTLGSA-N
Mol Weight 137.14 g/mol
Molecular Formula C713CH8O2
Exact Mass 137.055784 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1PWMD4yp07u
Name 2-Phenylacetic acid
Comments Original formula: C7[13C]H8O2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8O2
InChI InChI=1S/C8H8O2/c9-8(10)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,9,10)/i8+1
InChIKey WLJVXDMOQOGPHL-VJJZLTLGSA-N
Molecular Weight 137.142 g/mol
SMILES O[13C](=O)Cc1ccccc1
SPLASH splash10-000l-6900000000-6296d1f34146d92a37ac
Source of Spectrum C-109-557-0
Synonyms 2-Phenylethanoic acid
Wiley ID 1136085