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4-(benzenesulfinyl)-1-benzopyran-2-one
SpectraBase Compound ID E72kbgAAZ97
InChI InChI=1S/C15H10O3S/c16-15-10-14(12-8-4-5-9-13(12)18-15)19(17)11-6-2-1-3-7-11/h1-10H
InChIKey VLLPMQJXVRZAQR-UHFFFAOYSA-N
Mol Weight 270.3 g/mol
Molecular Formula C15H10O3S
Exact Mass 270.035065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7CApfjsETWs
Name 4-(benzenesulfinyl)-1-benzopyran-2-one
Alternate Name(s) 4-(benzenesulfinyl)chromen-2-one 4-(Benzenesulfinyl)coumarin 4-(Phenylsulfinyl)chromen-2-one
CAS Registry Number 127599-29-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H10O3S
InChI InChI=1S/C15H10O3S/c16-15-10-14(12-8-4-5-9-13(12)18-15)19(17)11-6-2-1-3-7-11/h1-10H
InChIKey VLLPMQJXVRZAQR-UHFFFAOYSA-N
Molecular Weight 270.302 g/mol
SMILES C1(=CC(=O)Oc2c1cccc2)S(=O)c1ccccc1
SPLASH splash10-000i-9320000000-7a45281f49a570bac881
Source of Spectrum F-45-7590-1
Wiley ID 1274075