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4-Methyl-3-phenylcoumarin

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

4-Methyl-3-phenylcoumarin
SpectraBase Compound ID DQSjevFlZrT
InChI InChI=1S/C16H12O2/c1-11-13-9-5-6-10-14(13)18-16(17)15(11)12-7-3-2-4-8-12/h2-10H,1H3
InChIKey LQPDCTIPWIJXCR-UHFFFAOYSA-N
Mol Weight 236.27 g/mol
Molecular Formula C16H12O2
Exact Mass 236.08373 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2i2Xs2Fui26
Name 4-Methyl-3-phenylcoumarin
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 391816
CAS Registry Number 23028-23-1
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12O2
InChI InChI=1S/C16H12O2/c1-11-13-9-5-6-10-14(13)18-16(17)15(11)12-7-3-2-4-8-12/h2-10H,1H3
InChIKey LQPDCTIPWIJXCR-UHFFFAOYSA-N
Observed nucleus 13C
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 4-Methyl-3-phenyl-2H-chromen-2-one
Wiley ID SIAL_13CNMR_008589