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(E)-4-(2,5-dimethylphenyl)-4-keto-but-2-enoic acid

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(E)-4-(2,5-dimethylphenyl)-4-keto-but-2-enoic acid
SpectraBase Compound ID F83uVN7Gs2j
InChI InChI=1S/C12H12O3/c1-8-3-4-9(2)10(7-8)11(13)5-6-12(14)15/h3-7H,1-2H3,(H,14,15)/b6-5+
InChIKey YHCFVGCMSKTDFZ-AATRIKPKSA-N
Mol Weight 204.22 g/mol
Molecular Formula C12H12O3
Exact Mass 204.078644 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Jzk4ufneeOc
Name trans-3-(2,5-Dimethylbenzoyl)acrylic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 346047
CAS Registry Number 15254-22-5
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O3
InChI InChI=1S/C12H12O3/c1-8-3-4-9(2)10(7-8)11(13)5-6-12(14)15/h3-7H,1-2H3,(H,14,15)/b6-5+
InChIKey YHCFVGCMSKTDFZ-AATRIKPKSA-N
Observed nucleus 13C
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms (2E)-4-(2,5-dimethylphenyl)-4-oxobut-2-enoic acid 4-(2,5-dimethylphenyl)-4-oxobut-2-enoic acid
Wiley ID SIAL_13CNMR_007211