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trans-3-Benzoylacrylic acid

View entire compound with spectra: 6 NMR, 3 FTIR, and 2 MS (GC)

trans-3-Benzoylacrylic acid
SpectraBase Compound ID LCqk0Rif1n
InChI InChI=1S/C10H8O3/c11-9(6-7-10(12)13)8-4-2-1-3-5-8/h1-7H,(H,12,13)/b7-6+
InChIKey PLPDHGOODMBBGN-VOTSOKGWSA-N
Mol Weight 176.17 g/mol
Molecular Formula C10H8O3
Exact Mass 176.047344 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5hjEa1JKSuI
Name trans-3-Benzoylacrylic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 452475
CAS Registry Number 17812-07-6
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H8O3
InChI InChI=1S/C10H8O3/c11-9(6-7-10(12)13)8-4-2-1-3-5-8/h1-7H,(H,12,13)/b7-6+
InChIKey PLPDHGOODMBBGN-VOTSOKGWSA-N
Observed nucleus 13C
Purity 97%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 4-Oxo-4-phenyl-2-butenoic acid
Wiley ID SIAL_13CNMR_009954