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N-[2-(1-adamantyloxy)ethyl]-2-(1,3-benzothiazol-2-ylsulfanyl)acetamide
SpectraBase Compound ID Z1XvkAYlQp
InChI InChI=1S/C21H26N2O2S2/c24-19(13-26-20-23-17-3-1-2-4-18(17)27-20)22-5-6-25-21-10-14-7-15(11-21)9-16(8-14)12-21/h1-4,14-16H,5-13H2,(H,22,24)/t14-,15+,16-,21-
InChIKey LPQIFNZKWWPYPV-OFIQSVQDSA-N
Mol Weight 402.57 g/mol
Molecular Formula C21H26N2O2S2
Exact Mass 402.14357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7HAeAWBHVrj
Name N-[2-(1-adamantyloxy)ethyl]-2-(1,3-benzothiazol-2-ylsulfanyl)acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26N2O2S2
InChI InChI=1S/C21H26N2O2S2/c24-19(13-26-20-23-17-3-1-2-4-18(17)27-20)22-5-6-25-21-10-14-7-15(11-21)9-16(8-14)12-21/h1-4,14-16H,5-13H2,(H,22,24)/t14-,15+,16-,21-
InChIKey LPQIFNZKWWPYPV-OFIQSVQDSA-N
Molecular Weight 402.571 g/mol
SMILES N(C(CSc1nc2ccccc2s1)=O)CCOC12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H]
SPLASH splash10-000i-1940000000-e43a7424d02eff4245f8
Synonyms N-[2-(1-adamantyloxy)ethyl]-2-(1,3-benzothiazol-2-ylsulfanyl)ethanamide N-[2-(1-adamantyloxy)ethyl]-2-(1,3-benzothiazol-2-ylthio)acetamide
Wiley ID 1442165