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Benzo[1,2,5]thiadiazole-4-sulfonic acid [2-(adamantan-1-yloxy)-ethyl]-amide
SpectraBase Compound ID Dov92pS451M
InChI InChI=1S/C18H23N3O3S2/c22-26(23,16-3-1-2-15-17(16)21-25-20-15)19-4-5-24-18-9-12-6-13(10-18)8-14(7-12)11-18/h1-3,12-14,19H,4-11H2/t12-,13+,14-,18-
InChIKey ZRXAPLLMGHKBJL-WXZYKRPKSA-N
Mol Weight 393.52 g/mol
Molecular Formula C18H23N3O3S2
Exact Mass 393.118084 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7HCkyB7R04x
Name Benzo[1,2,5]thiadiazole-4-sulfonic acid [2-(adamantan-1-yloxy)-ethyl]-amide
Alternate Name(s) N-[2-(1-Adamantyloxy)ethyl]-2,1,3-benzothiadiazole-4-sulfonamide N-[2-(1-adamantyloxy)ethyl]piazthiole-4-sulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23N3O3S2
InChI InChI=1S/C18H23N3O3S2/c22-26(23,16-3-1-2-15-17(16)21-25-20-15)19-4-5-24-18-9-12-6-13(10-18)8-14(7-12)11-18/h1-3,12-14,19H,4-11H2/t12-,13+,14-,18-
InChIKey ZRXAPLLMGHKBJL-WXZYKRPKSA-N
Molecular Weight 393.520 g/mol
SMILES N(S(c1c2nsnc2ccc1)(=O)=O)CCOC12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H]
SPLASH splash10-000i-5900000000-4fc7b9b5b5a3488a3f1b
Wiley ID 1461496