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N,N-Diisobutyl-2,2-dimethyl-4-trifluoroacetyl-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
SpectraBase Compound ID 2PltQCZav5r
InChI InChI=1S/C20H29F3N2O3S2/c1-13(2)10-24(11-14(3)4)30(27,28)15-7-8-17-16(9-15)25(12-19(5,6)29-17)18(26)20(21,22)23/h7-9,13-14H,10-12H2,1-6H3
InChIKey HAWYXIFZKLJMEF-UHFFFAOYSA-N
Mol Weight 466.58 g/mol
Molecular Formula C20H29F3N2O3S2
Exact Mass 466.15717 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DrUNep10ATE
Name N,N-Diisobutyl-2,2-dimethyl-4-trifluoroacetyl-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
Appearance Light yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H29F3N2O3S2
InChI InChI=1S/C20H29F3N2O3S2/c1-13(2)10-24(11-14(3)4)30(27,28)15-7-8-17-16(9-15)25(12-19(5,6)29-17)18(26)20(21,22)23/h7-9,13-14H,10-12H2,1-6H3
InChIKey HAWYXIFZKLJMEF-UHFFFAOYSA-N
Instrument Name HP 6890-5973
Ionization Type EI
Literature Reference DOI 10.1021/jm400435a
Molecular Weight 466.578 g/mol
SMILES c1(S(N(CC(C)C)CC(C)C)(=O)=O)ccc2SC(C)(CN(c2c1)C(C(F)(F)F)=O)C
SPLASH splash10-00di-0065900000-0753092e9744c79d9d0d
Source of Spectrum AF-56-4725-26
Wiley ID 1854544