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1-[2-(3,3-Dimethyl-2-oxo-butyl)-2-hydroxy-4H-benzo[1,4]thiazin-3-ylidene]-3,3-dimethyl-butan-2-one
SpectraBase Compound ID JVCJ3hExeAt
InChI InChI=1S/C20H27NO3S/c1-18(2,3)16(22)11-15-20(24,12-17(23)19(4,5)6)25-14-10-8-7-9-13(14)21-15/h7-11,21,24H,12H2,1-6H3/b15-11-
InChIKey JUPVHJSNPBLYQW-PTNGSMBKSA-N
Mol Weight 361.5 g/mol
Molecular Formula C20H27NO3S
Exact Mass 361.171165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Byne1QHi83U
Name 1-[2-(3,3-Dimethyl-2-oxo-butyl)-2-hydroxy-4H-benzo[1,4]thiazin-3-ylidene]-3,3-dimethyl-butan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H27NO3S
InChI InChI=1S/C20H27NO3S/c1-18(2,3)16(22)11-15-20(24,12-17(23)19(4,5)6)25-14-10-8-7-9-13(14)21-15/h7-11,21,24H,12H2,1-6H3/b15-11-
InChIKey JUPVHJSNPBLYQW-PTNGSMBKSA-N
Molecular Weight 361.500 g/mol
SMILES N1c2c(SC(\C1=C/C(C(C)(C)C)=O)(CC(C(C)(C)C)=O)O)cccc2
SPLASH splash10-001i-3590000000-d4774508fdfc284796da
Synonyms 1-[(3Z)-2-hydroxy-3-(2-keto-3,3-dimethyl-butylidene)-4H-1,4-benzothiazin-2-yl]-3,3-dimethyl-butan-2-one 1-[(3Z)-3-(3,3-dimethyl-2-oxidanylidene-butylidene)-2-oxidanyl-4H-1,4-benzothiazin-2-yl]-3,3-dimethyl-butan-2-one 1-[(3Z)-3-(3,3-dimethyl-2-oxo-butylidene)-2-hydroxy-4H-1,4-benzothiazin-2-yl]-3,3-dimethyl-butan-2-one 1-[(3Z)-3-(3,3-dimethyl-2-oxobutylidene)-2-hydroxy-4H-1,4-benzothiazin-2-yl]-3,3-dimethyl-2-butanone
Wiley ID 1464629