SpectraBase Spectrum ID |
Azdm9QkrNA0 |
Name |
4'-[(3-Butyl-1H-1,2,4-triazol-1-yl)methyl]biphenyl-2-tetrazole |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H21N7 |
InChI |
InChI=1S/C20H21N7/c1-2-3-8-19-21-14-27(24-19)13-15-9-11-16(12-10-15)17-6-4-5-7-18(17)20-22-25-26-23-20/h4-7,9-12,14H,2-3,8,13H2,1H3,(H,22,23,25,26) |
InChIKey |
COLOZRIIPMCJDO-UHFFFAOYSA-N |
Molecular Weight |
359.437 g/mol |
SMILES |
[nH]1c(nnn1)-c1c(-c2ccc(C[n]3nc(CCCC)nc3)cc2)cccc1 |
SPLASH |
splash10-0a6r-0509000000-a0038903e8c8f6b0b56b |
Source of Spectrum |
QA-43-88-11 |
Synonyms |
5-[2-[4-[(3-butyl-1,2,4-triazol-1-yl)methyl]phenyl]phenyl]-2H-1,2,3,4-tetrazole |
Wiley ID |
862151 |