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3-Bromocinnamic acid, predominantly trans

View entire compound with spectra: 2 NMR, 2 FTIR, and 1 Raman

3-Bromocinnamic acid, predominantly trans
SpectraBase Compound ID Bl1mAJvD7DT
InChI InChI=1S/C9H7BrO2/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-6H,(H,11,12)/b5-4+
InChIKey YEMUSDCFQUBPAL-SNAWJCMRSA-N
Mol Weight 227.06 g/mol
Molecular Formula C9H7BrO2
Exact Mass 225.962942 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4wDhGU4LFSx
Name 3-Bromocinnamic acid, predominantly trans
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 118931
CAS Registry Number 32862-97-8
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7BrO2
InChI InChI=1S/C9H7BrO2/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-6H,(H,11,12)/b5-4+
InChIKey YEMUSDCFQUBPAL-SNAWJCMRSA-N
Observed nucleus 13C
Purity 98%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_000527