| SpectraBase Spectrum ID |
EYVaTLxFHdt |
| Name |
3-Benzyl-2-{[1-(3-chloropropyl)-1H-1,2,3-triazol-4-yl]methyl}-4-n-propylisoquinolin-1(2H)-one |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H27ClN4O |
| InChI |
InChI=1S/C25H27ClN4O/c1-2-9-22-21-12-6-7-13-23(21)25(31)30(24(22)16-19-10-4-3-5-11-19)18-20-17-29(28-27-20)15-8-14-26/h3-7,10-13,17H,2,8-9,14-16,18H2,1H3 |
| InChIKey |
NSKGSQRQUGYROY-UHFFFAOYSA-N |
| Instrument Name |
Jeol AccuTOF |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201904110 |
| Molecular Weight |
434.971 g/mol |
| Reported Formula |
C25H27(35)ClN4O |
| SMILES |
c1cc2c(cc1)C(=C(N(C2=O)Cc1c[n](nn1)CCCCl)Cc1ccccc1)CCC |
| SPLASH |
splash10-003s-1091100000-c676587b349da48c4704 |
| Source of Spectrum |
ACI-58-SM8-3ca |
| Wiley ID |
1875459 |
![3-Benzyl-2-{[1-(3-chloropropyl)-1H-1,2,3-triazol-4-yl]methyl}-4-n-propylisoquinolin-1(2H)-one](/api/spectrum/EYVaTLxFHdt/structure.png?h=300&w=458 "3-Benzyl-2-{[1-(3-chloropropyl)-1H-1,2,3-triazol-4-yl]methyl}-4-n-propylisoquinolin-1(2H)-one")
