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3-benzoylcoumarin

View entire compound with spectra: 2 NMR, 1 FTIR, 3 UV-Vis, and 2 MS (GC)

3-benzoylcoumarin
SpectraBase Compound ID 2FurFLRlYZP
InChI InChI=1S/C16H10O3/c17-15(11-6-2-1-3-7-11)13-10-12-8-4-5-9-14(12)19-16(13)18/h1-10H
InChIKey LPBMPRKJYKSRLL-UHFFFAOYSA-N
Mol Weight 250.25 g/mol
Molecular Formula C16H10O3
Exact Mass 250.062994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GeZIKxfsWaL
Name 2H-1-Benzopyran-2-one, 3-benzoyl-
Alternate Name(s) Coumarin, 3-benzoyl- 3-(Phenylcarbonyl)chromen-2-one 3-Benzoyl-1-benzopyran-2-one 3-Benzoyl-2H-1-benzopyran-2-one 3-Benzoyl-2H-chromen-2-one 3-Benzoylchromen-2-one 3-Benzoylcoumarin BRN 0190875 NSC 11862
CAS Registry Number 1846-74-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H10O3
InChI InChI=1S/C16H10O3/c17-15(11-6-2-1-3-7-11)13-10-12-8-4-5-9-14(12)19-16(13)18/h1-10H
InChIKey LPBMPRKJYKSRLL-UHFFFAOYSA-N
Molecular Weight 250.253 g/mol
SMILES C(=O)(C1=Cc2c(cccc2)OC1=O)c1ccccc1
SPLASH splash10-0pi0-0690000000-75afd9519f1e11d52353
Source of Spectrum F-38-1209-0
Wiley ID 1253790