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

*Links on SpectraBase are not permalinks.
N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[5-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrazol-2-yl]ethanamide
SpectraBase Compound ID FyhbisJg8cL
InChI InChI=1S/C23H23F3N6OS/c1-22(2,3)14-7-8-16-17(11-27)21(34-18(16)10-14)28-19(33)12-32-30-20(29-31-32)13-5-4-6-15(9-13)23(24,25)26/h4-6,9,14H,7-8,10,12H2,1-3H3,(H,28,33)
InChIKey FCCXHPNFLCAIJK-UHFFFAOYSA-N
Mol Weight 488.53 g/mol
Molecular Formula C23H23F3N6OS
Exact Mass 488.160615 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 HH1DQHRVABv
Name N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[5-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrazol-2-yl]ethanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H23F3N6OS
InChI InChI=1S/C23H23F3N6OS/c1-22(2,3)14-7-8-16-17(11-27)21(34-18(16)10-14)28-19(33)12-32-30-20(29-31-32)13-5-4-6-15(9-13)23(24,25)26/h4-6,9,14H,7-8,10,12H2,1-3H3,(H,28,33)
InChIKey FCCXHPNFLCAIJK-UHFFFAOYSA-N
Molecular Weight 488.533 g/mol
SMILES N(C(C[n]1nc(nn1)-c1cccc(c1)C(F)(F)F)=O)c1c(c2c(s1)CC(CC2)C(C)(C)C)C#N
SPLASH splash10-0007-9400000000-f610391cbde6299dba47
Synonyms N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[5-[3-(trifluoromethyl)phenyl]-2-tetrazolyl]acetamide N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[5-[3-(trifluoromethyl)phenyl]tetrazol-2-yl]acetamide N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-[5-[3-(trifluoromethyl)phenyl]tetrazol-2-yl]acetamide
Wiley ID 1512390