| SpectraBase Spectrum ID |
rTHRQFZCZ4 |
| Name |
N-((2-chloroquinolin-3-yl)(1-(2,4,4-trimethylpentan-2-yl)-1H-tetrazol-5-yl)methyl)-3-methylaniline |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H31ClN6 |
| InChI |
InChI=1S/C26H31ClN6/c1-17-10-9-12-19(14-17)28-22(20-15-18-11-7-8-13-21(18)29-23(20)27)24-30-31-32-33(24)26(5,6)16-25(2,3)4/h7-15,22,28H,16H2,1-6H3 |
| InChIKey |
KCKPEYIGVVGLJQ-UHFFFAOYSA-N |
| Instrument Name |
Agilent technologies HP 5937 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.2546 |
| Molecular Weight |
463.029 g/mol |
| SMILES |
N(C(c1c(Cl)nc2c(c1)cccc2)c1nnn[n]1C(CC(C)(C)C)(C)C)c1cccc(c1)C |
| SPLASH |
splash10-0f89-0095200000-0c246c620fd16eddd69b |
| Source of Spectrum |
Y-54-107-6i |
| Wiley ID |
1877758 |
