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3-Oxo-5-phenylpentanoic acid
SpectraBase Compound ID 13hieUT5nns
InChI InChI=1S/C11H12O3/c12-10(8-11(13)14)7-6-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,13,14)
InChIKey MTSYUWNVCAQHSK-UHFFFAOYSA-N
Mol Weight 192.21 g/mol
Molecular Formula C11H12O3
Exact Mass 192.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B6BvlsZyIFW
Name 3-Oxo-5-phenylpentanoic acid
Alternate Name(s) 3-keto-5-phenyl-valeric acid 3-Oxidanylidene-5-phenyl-pentanoic acid
CAS Registry Number 54680-53-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O3
InChI InChI=1S/C11H12O3/c12-10(8-11(13)14)7-6-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,13,14)
InChIKey MTSYUWNVCAQHSK-UHFFFAOYSA-N
Molecular Weight 192.214 g/mol
SMILES OC(CC(CCc1ccccc1)=O)=O
SPLASH splash10-0006-9500000000-6bbae73c6906f4ce9e30
Wiley ID 1475144