| SpectraBase Spectrum ID |
ArPTrUjltkm |
| Name |
3-(4-Bromobenzyl)-2-[(1-n-hexyl-1H-1,2,3-triazol-4-yl)methyl]-4-n-propylisoquinolin-1(2H)-one |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H33BrN4O |
| InChI |
InChI=1S/C28H33BrN4O/c1-3-5-6-9-17-32-19-23(30-31-32)20-33-27(18-21-13-15-22(29)16-14-21)25(10-4-2)24-11-7-8-12-26(24)28(33)34/h7-8,11-16,19H,3-6,9-10,17-18,20H2,1-2H3 |
| InChIKey |
UTIFINYVOXKTTN-UHFFFAOYSA-N |
| Instrument Name |
Jeol AccuTOF |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201904110 |
| Molecular Weight |
521.503 g/mol |
| Reported Formula |
C28H33(81)BrN4O |
| SMILES |
c1cc2c(cc1)C(=C(N(C2=O)Cc1c[n](nn1)CCCCCC)Cc1ccc(cc1)Br)CCC |
| SPLASH |
splash10-022j-5598060000-a4a4d317bfffe8c4cb47 |
| Source of Spectrum |
ACI-58-SM25-3ae |
| Wiley ID |
1875455 |
![3-(4-Bromobenzyl)-2-[(1-n-hexyl-1H-1,2,3-triazol-4-yl)methyl]-4-n-propylisoquinolin-1(2H)-one](/api/spectrum/ArPTrUjltkm/structure.png?h=300&w=458 "3-(4-Bromobenzyl)-2-[(1-n-hexyl-1H-1,2,3-triazol-4-yl)methyl]-4-n-propylisoquinolin-1(2H)-one")
