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p-chloromandelic acid

View entire compound with spectra: 3 NMR, 3 FTIR, and 2 MS (GC)

p-chloromandelic acid
SpectraBase Compound ID 7E0USPZOt7E
InChI InChI=1S/C8H7ClO3/c9-6-3-1-5(2-4-6)7(10)8(11)12/h1-4,7,10H,(H,11,12)
InChIKey BWSFWXSSALIZAU-UHFFFAOYSA-N
Mol Weight 186.59 g/mol
Molecular Formula C8H7ClO3
Exact Mass 186.008372 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7t4EbA23PVA
Name p-CHLORO-DL-MANDELIC ACID
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
CAS Registry Number 7138-34-3
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7ClO3
InChI InChI=1S/C8H7ClO3/c9-6-3-1-5(2-4-6)7(10)8(11)12/h1-4,7,10H,(H,11,12)
InChIKey BWSFWXSSALIZAU-UHFFFAOYSA-N
Melting Point 120C
Molecular Weight 186.60
Solvent Dimethyl sulfoxide-d6; Reference=TMS Spectrometer= Bruker AC-300
Synonyms MANDELIC ACID, p-CHLORO-, DL-,