| SpectraBase Spectrum ID |
GNjmWU4HwvC |
| Name |
2-[2-(1-Benzyl-1H-1,2,3-triazol-4-yl)propan-2-yl]isoquinolin-1(2H)-one |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H20N4O |
| InChI |
InChI=1S/C21H20N4O/c1-21(2,25-13-12-17-10-6-7-11-18(17)20(25)26)19-15-24(23-22-19)14-16-8-4-3-5-9-16/h3-13,15H,14H2,1-2H3 |
| InChIKey |
NPZWDGJIBUWXJD-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT 95 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201700587 |
| Molecular Weight |
344.418 g/mol |
| Quality |
93 |
| Reported Formula |
C21H20N4O |
| SMILES |
C1(N(C=CC2=C1C=CC=C2)C(C=1N=NN(CC2=CC=CC=C2)C1)(C)C)=O |
| SPLASH |
splash10-0006-9530000000-707387ed7e7deab9c87d |
| Source of Spectrum |
QE-23-SM26-5ad (DOI: 10.1002/chem.201700587) |
| Wiley ID |
1903722 |
![2-[2-(1-Benzyl-1H-1,2,3-triazol-4-yl)propan-2-yl]isoquinolin-1(2H)-one](/api/spectrum/GNjmWU4HwvC/structure.png?h=300&w=458 "2-[2-(1-Benzyl-1H-1,2,3-triazol-4-yl)propan-2-yl]isoquinolin-1(2H)-one")
