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4H-1-Benzothiopyran-4-one, 3,3-dihydro-6-methyl-3-(methylimino)-, N-oxide
SpectraBase Compound ID vKje1rrhhT
InChI InChI=1S/C11H11NO2S/c1-7-3-4-10-8(5-7)11(13)9(6-15-10)12(2)14/h3-5H,6H2,1-2H3/b12-9+
InChIKey QXACLPYSTJHLFW-FMIVXFBMSA-N
Mol Weight 221.27 g/mol
Molecular Formula C11H11NO2S
Exact Mass 221.05105 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6iqJL0H42wU
Name 4H-1-Benzothiopyran-4-one, 3,3-dihydro-6-methyl-3-(methylimino)-, N-oxide
Alternate Name(s) (3Z)-6-methyl-3-[methyl(oxido)imino]-2,3-dihydro-4H-1-benzothiopyran-4-one 6-Methyl-3-methylimino-4-oxo-3,4-dihydro-2H-1-benzothiopyran-N-oxide
CAS Registry Number 61424-11-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11NO2S
InChI InChI=1S/C11H11NO2S/c1-7-3-4-10-8(5-7)11(13)9(6-15-10)12(2)14/h3-5H,6H2,1-2H3/b12-9+
InChIKey QXACLPYSTJHLFW-FMIVXFBMSA-N
Molecular Weight 221.274 g/mol
SMILES C1(\C(CSc2ccc(cc12)C)=[N+]/([O-])C)=O
SPLASH splash10-0a6r-0690000000-8439b74ced3eddbb286d
Source of Spectrum K-109-3472-0
Wiley ID 1221116