For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

2-(1-Adamantylamino)-5-(4-nitrophenyl)-1,3,4-thiadiazole

View entire compound with spectra: 1 MS (GC)

2-(1-Adamantylamino)-5-(4-nitrophenyl)-1,3,4-thiadiazole
SpectraBase Compound ID DxRJkhDGuwh
InChI InChI=1S/C18H20N4O2S/c23-22(24)15-3-1-14(2-4-15)16-20-21-17(25-16)19-18-8-11-5-12(9-18)7-13(6-11)10-18/h1-4,11-13H,5-10H2,(H,19,21)/t11-,12+,13-,18-
InChIKey WQCVRYMOGZHNFV-MCXHQAMOSA-N
Mol Weight 356.44 g/mol
Molecular Formula C18H20N4O2S
Exact Mass 356.130697 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID n4Z1HL2zg
Name 2-(1-Adamantylamino)-5-(4-nitrophenyl)-1,3,4-thiadiazole
Alternate Name(s) N-((3s,5s,7s)-adamantan-1-yl)-5-(4-nitrophenyl)-1,3,4-thiadiazol-2-amine N-(1-adamantyl)-5-(4-nitrophenyl)-1,3,4-thiadiazol-2-amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20N4O2S
InChI InChI=1S/C18H20N4O2S/c23-22(24)15-3-1-14(2-4-15)16-20-21-17(25-16)19-18-8-11-5-12(9-18)7-13(6-11)10-18/h1-4,11-13H,5-10H2,(H,19,21)/t11-,12+,13-,18-
InChIKey WQCVRYMOGZHNFV-MCXHQAMOSA-N
Molecular Weight 356.444 g/mol
SMILES N(C12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])c1sc(nn1)-c1ccc(N(=O)=O)cc1
SPLASH splash10-000f-9630000000-ea89a6302de247b2dbfa
Source of Spectrum EMC-42-240-8e
Wiley ID 1735150