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Mandelic acid, p-cyano-
SpectraBase Compound ID 8yxEv8bM1lD
InChI InChI=1S/C9H7NO3/c10-5-6-1-3-7(4-2-6)8(11)9(12)13/h1-4,8,11H,(H,12,13)
InChIKey WNSURQHMHJSIGA-UHFFFAOYSA-N
Mol Weight 177.16 g/mol
Molecular Formula C9H7NO3
Exact Mass 177.042593 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ad5zehmhVvX
Name Mandelic acid, p-cyano-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7NO3
InChI InChI=1S/C9H7NO3/c10-5-6-1-3-7(4-2-6)8(11)9(12)13/h1-4,8,11H,(H,12,13)
InChIKey WNSURQHMHJSIGA-UHFFFAOYSA-N
Molecular Weight 177.159 g/mol
SMILES OC(C(=O)O)c1ccc(C#N)cc1
SPLASH splash10-0ugi-8900000000-0e086930d207016d7456
Synonyms (4-Cyanophenyl)(hydroxy)acetic acid 2-(4-cyanophenyl)-2-hydroxy-acetic acid 2-(4-cyanophenyl)-2-oxidanyl-ethanoic acid
Wiley ID 1497874