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N-isobutyl-7-nitro-5-(trifluoromethyl)-2-benzothiazolecarboxamide, 3-oxide
SpectraBase Compound ID ESr5tU3tBix
InChI InChI=1S/C13H12F3N3O4S/c1-6(2)5-17-11(20)12-18(21)8-3-7(13(14,15)16)4-9(19(22)23)10(8)24-12/h3-4,6H,5H2,1-2H3,(H,17,20)
InChIKey WBOKCPSYEKWFLA-UHFFFAOYSA-N
Mol Weight 363.31 g/mol
Molecular Formula C13H12F3N3O4S
Exact Mass 363.050062 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 1DVHsllzyuf
Name N-ISOBUTYL-7-NITRO-5-(TRIFLUOROMETHYL)-2-BENZOTHIAZOLECARBOXAMIDE, 3-OXIDE
Source of Sample K. Wagner, Bayer AG, Leverkusen, Germany
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12F3N3O4S
InChI InChI=1S/C13H12F3N3O4S/c1-6(2)5-17-11(20)12-18(21)8-3-7(13(14,15)16)4-9(19(22)23)10(8)24-12/h3-4,6H,5H2,1-2H3,(H,17,20)
InChIKey WBOKCPSYEKWFLA-UHFFFAOYSA-N
Literature Reference Abstract-Chemical Abstracts= 78, 111189(1973)
Melting Point 157-158C
Molecular Weight 363.311189
Synonyms 2-BENZOTHIAZOLECARBOXAMIDE, N-ISO- BUTYL-7-NITRO-5-/TRIFLUOROMETHYL/-, 3-OXIDE
Technique KBr WAFER