| SpectraBase Spectrum ID |
7nr2MownIu6 |
| Name |
N-((1-Benzyl-1H-1,2,3-triazol-4-yl)methyl)-5-(4-chlorophenyl)isoxazole-3-carboxamide |
| Appearance |
Off-white crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
393.099252473 u |
| Formula |
C20H16ClN5O2 |
| InChI |
InChI=1S/C20H16ClN5O2/c21-16-8-6-15(7-9-16)19-10-18(24-28-19)20(27)22-11-17-13-26(25-23-17)12-14-4-2-1-3-5-14/h1-10,13H,11-12H2,(H,22,27) |
| InChIKey |
BLLZYURSILKNGJ-UHFFFAOYSA-N |
| Instrument Name |
Agilent Technology |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.2273 |
| Molecular Weight |
393.834 g/mol |
| Quality |
153 |
| SMILES |
N(CC=1N=NN(CC2=CC=CC=C2)C1)C(=O)C1=NOC(=C1)C1=CC=C(C=C1)Cl |
| SPLASH |
splash10-0096-1923000000-f6472831b6ca8af0b020 |
| Source of Spectrum |
Y-52-1746-7i (DOI: 10.1002/jhet.2273) |
| Wiley ID |
1902625 |
