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isobutyl 3-methyl-6-(trifluoromethyl)-4H-1,4-benzothiazine-2-carboxylate
SpectraBase Compound ID 7habysM39ES
InChI InChI=1S/C15H16F3NO2S/c1-8(2)7-21-14(20)13-9(3)19-11-6-10(15(16,17)18)4-5-12(11)22-13/h4-6,8,19H,7H2,1-3H3
InChIKey UCMSFGSFHPCQCU-UHFFFAOYSA-N
Mol Weight 331.35 g/mol
Molecular Formula C15H16F3NO2S
Exact Mass 331.085384 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7xK6j5cd8OZ
Name Isobutyl 3-methyl-6-(trifluoromethyl)-4H-1,4-benzothiazine-2-carboxylate
CAS Registry Number 296247-23-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16F3NO2S
InChI InChI=1S/C15H16F3NO2S/c1-8(2)7-21-14(20)13-9(3)19-11-6-10(15(16,17)18)4-5-12(11)22-13/h4-6,8,19H,7H2,1-3H3
InChIKey UCMSFGSFHPCQCU-UHFFFAOYSA-N
Molecular Weight 331.353 g/mol
SMILES N1c2cc(ccc2SC(=C1C)C(OCC(C)C)=O)C(F)(F)F
SPLASH splash10-001i-7692000000-6fe8006e2dbef9e0d94a
Source of Spectrum AD-0-2532-0
Synonyms 2-Methylpropyl 3-methyl-6-(trifluoromethyl)-4H-1,4-benzothiazine-2-carboxylate 3-Methyl-6-(trifluoromethyl)-4H-1,4-benzothiazine-2-carboxylic acid 2-methylpropyl ester 3-Methyl-6-(trifluoromethyl)-4H-1,4-benzothiazine-2-carboxylic acid isobutyl ester 4H-1,4-Benzothiazine-2-carboxylic acid, 6-trifluoromethyl-3-methyl-, 2-methylpropyl ester
Wiley ID 1429708