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5-Methyl-benzo[1,2,5]thiadiazole-4-sulfonic acid (2-adamantan-1-yl-ethyl)-amide
SpectraBase Compound ID ISyHZLHWc3F
InChI InChI=1S/C19H25N3O2S2/c1-12-2-3-16-17(22-25-21-16)18(12)26(23,24)20-5-4-19-9-13-6-14(10-19)8-15(7-13)11-19/h2-3,13-15,20H,4-11H2,1H3
InChIKey CXSUKPBWBHAGQC-UHFFFAOYSA-N
Mol Weight 391.55 g/mol
Molecular Formula C19H25N3O2S2
Exact Mass 391.138819 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2E0LxAGJVCv
Name 5-Methyl-benzo[1,2,5]thiadiazole-4-sulfonic acid (2-adamantan-1-yl-ethyl)-amide
Alternate Name(s) N-[2-(1-Adamantyl)ethyl]-5-methyl-2,1,3-benzothiadiazole-4-sulfonamide N-[2-(1-adamantyl)ethyl]-5-methyl-piazthiole-4-sulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H25N3O2S2
InChI InChI=1S/C19H25N3O2S2/c1-12-2-3-16-17(22-25-21-16)18(12)26(23,24)20-5-4-19-9-13-6-14(10-19)8-15(7-13)11-19/h2-3,13-15,20H,4-11H2,1H3
InChIKey CXSUKPBWBHAGQC-UHFFFAOYSA-N
Molecular Weight 391.548 g/mol
SMILES N(S(c1c2c(nsn2)ccc1C)(=O)=O)CCC12CC3CC(C2)CC(C1)C3
SPLASH splash10-004i-2900000000-9cd947c9cfbd2bdb845a
Wiley ID 1463582