| SpectraBase Spectrum ID |
7AKOxLWWDeS |
| Name |
2-[2-(1-Benzyl-1H-1,2,3-triazol-4-yl)propan-2-yl]-6-chloroisoquinolin-1(2H)-one |
| Appearance |
Yellowish solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
378.124738947 u |
| Formula |
C21H19ClN4O |
| InChI |
InChI=1S/C21H19ClN4O/c1-21(2,19-14-25(24-23-19)13-15-6-4-3-5-7-15)26-11-10-16-12-17(22)8-9-18(16)20(26)27/h3-12,14H,13H2,1-2H3 |
| InChIKey |
LKYCHEXMGYVHGK-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT 95 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201700587 |
| Molecular Weight |
378.863 g/mol |
| Quality |
108 |
| Reported Formula |
C21H19ClN4O |
| SMILES |
C1(N(C=CC2=C1C=CC(=C2)Cl)C(C=1N=NN(CC2=CC=CC=C2)C1)(C)C)=O |
| SPLASH |
splash10-0006-9151000000-0f219a6efeef1bc10028 |
| Source of Spectrum |
QE-23-SM28-5jd (DOI: 10.1002/chem.201700587) |
| Wiley ID |
1903725 |
![2-[2-(1-Benzyl-1H-1,2,3-triazol-4-yl)propan-2-yl]-6-chloroisoquinolin-1(2H)-one](/api/spectrum/7AKOxLWWDeS/structure.png?h=300&w=458 "2-[2-(1-Benzyl-1H-1,2,3-triazol-4-yl)propan-2-yl]-6-chloroisoquinolin-1(2H)-one")
