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2-Propenoic acid, 2-cyano-3-(4-hydroxyphenyl)-

View entire compound with spectra: 2 NMR, 2 FTIR, 1 Raman, and 1 MS (GC)

2-Propenoic acid, 2-cyano-3-(4-hydroxyphenyl)-
SpectraBase Compound ID J3cvqmwiicH
InChI InChI=1S/C10H7NO3/c11-6-8(10(13)14)5-7-1-3-9(12)4-2-7/h1-5,12H,(H,13,14)/b8-5+
InChIKey AFVLVVWMAFSXCK-VMPITWQZSA-N
Mol Weight 189.17 g/mol
Molecular Formula C10H7NO3
Exact Mass 189.042593 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID F655y1cbfIj
Name alpha-Cyano-4-hydroxycinnamic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 145505
CAS Registry Number 28166-41-8
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H7NO3
InChI InChI=1S/C10H7NO3/c11-6-8(10(13)14)5-7-1-3-9(12)4-2-7/h1-5,12H,(H,13,14)/b8-5+
InChIKey AFVLVVWMAFSXCK-VMPITWQZSA-N
Observed nucleus 1H
Purity 97%
Solvent CDCl3 & DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms alpha-Cyano-4-hydroxycinnamic acid alpha-CCA alpha-CHCA alpha-Cyano 4-HCCA ACCA
Wiley ID SIAL_1HNMR_001320