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3-Benzyl-4-hydroxycoumarin

View entire compound with spectra: 3 NMR, 1 FTIR, and 1 MS (GC)

3-Benzyl-4-hydroxycoumarin
SpectraBase Compound ID LXXmcA1A9L0
InChI InChI=1S/C16H12O3/c17-15-12-8-4-5-9-14(12)19-16(18)13(15)10-11-6-2-1-3-7-11/h1-9,17H,10H2
InChIKey AEIVRFFWQSJCAR-UHFFFAOYSA-N
Mol Weight 252.27 g/mol
Molecular Formula C16H12O3
Exact Mass 252.078644 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kv4NdLnI176
Name 4-Hydroxy-3-benzyl-coumarin
CAS Registry Number 15074-18-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H12O3
InChI InChI=1S/C16H12O3/c17-15-12-8-4-5-9-14(12)19-16(18)13(15)10-11-6-2-1-3-7-11/h1-9,17H,10H2
InChIKey AEIVRFFWQSJCAR-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference A. Rabaron, J.R. Didry, M.M.Plat, Org. Magn. Resonance 12, 284 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6