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3-(1H-indol-2-yl)-2-benzopyran-1-one
SpectraBase Compound ID LouJDG9f2mh
InChI InChI=1S/C17H11NO2/c19-17-13-7-3-1-5-11(13)10-16(20-17)15-9-12-6-2-4-8-14(12)18-15/h1-10,18H
InChIKey GKSIWZYXVFNECN-UHFFFAOYSA-N
Mol Weight 261.28 g/mol
Molecular Formula C17H11NO2
Exact Mass 261.078979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8tOfXYY7gpF
Name 3-(1H-indol-2-yl)-2-benzopyran-1-one
Alternate Name(s) 3-(1H-indol-2-yl)isochromen-1-one 3-(1H-indol-2-yl)isocoumarin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H11NO2
InChI InChI=1S/C17H11NO2/c19-17-13-7-3-1-5-11(13)10-16(20-17)15-9-12-6-2-4-8-14(12)18-15/h1-10,18H
InChIKey GKSIWZYXVFNECN-UHFFFAOYSA-N
Molecular Weight 261.280 g/mol
SMILES [nH]1c2ccccc2cc1C=1OC(=O)c2c(C1)cccc2
SPLASH splash10-03di-0090000000-03670d62e80e3e836df5
Source of Spectrum J-60-3716-13
Wiley ID 1265002