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benzyl 3-methyl-6-(trifluoromethyl)-4H-1,4-benzothiazine-2-carboxylate
SpectraBase Compound ID 7jSU770Kc3O
InChI InChI=1S/C18H14F3NO2S/c1-11-16(17(23)24-10-12-5-3-2-4-6-12)25-15-8-7-13(18(19,20)21)9-14(15)22-11/h2-9,22H,10H2,1H3
InChIKey IPYHHPHWASIDHV-UHFFFAOYSA-N
Mol Weight 365.37 g/mol
Molecular Formula C18H14F3NO2S
Exact Mass 365.069734 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JBbU3QW71ho
Name Benzyl 3-methyl-6-(trifluoromethyl)-4H-1,4-benzothiazine-2-carboxylate
CAS Registry Number 296247-15-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14F3NO2S
InChI InChI=1S/C18H14F3NO2S/c1-11-16(17(23)24-10-12-5-3-2-4-6-12)25-15-8-7-13(18(19,20)21)9-14(15)22-11/h2-9,22H,10H2,1H3
InChIKey IPYHHPHWASIDHV-UHFFFAOYSA-N
Molecular Weight 365.370 g/mol
SMILES N1c2cc(ccc2SC(=C1C)C(OCc1ccccc1)=O)C(F)(F)F
SPLASH splash10-0006-9331000000-d023b032c6ac652c4b7d
Source of Spectrum AD-0-2532-0
Synonyms (phenylmethyl) 3-methyl-6-(trifluoromethyl)-4H-1,4-benzothiazine-2-carboxylate 3-Methyl-6-(trifluoromethyl)-4H-1,4-benzothiazine-2-carboxylic acid (phenylmethyl) ester 3-Methyl-6-(trifluoromethyl)-4H-1,4-benzothiazine-2-carboxylic acid benzyl ester 4H-1,4-Benzothiazine-2-carboxylic acid, 6-trifluoromethyl-3-methyl-, benzyl ester
Wiley ID 1429720