| SpectraBase Spectrum ID |
CH3Kpfdd6Ud |
| Name |
O-benzylisotopsentin |
| CAS Registry Number |
116725-96-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H20N4O2 |
| InChI |
InChI=1S/C27H20N4O2/c32-26(21-14-28-22-9-5-4-8-20(21)22)27-29-15-25(31-27)24-12-18-10-11-19(13-23(18)30-24)33-16-17-6-2-1-3-7-17/h1-15,28,30H,16H2,(H,29,31) |
| InChIKey |
QBFQMEOUAKEHQR-UHFFFAOYSA-N |
| Molecular Weight |
432.483 g/mol |
| SMILES |
[nH]1c(C(c2c[nH]c3c2cccc3)=O)ncc1-c1[nH]c2cc(ccc2c1)OCc1ccccc1 |
| SPLASH |
splash10-0006-6905100000-24fe89fa9a90aedcfe63 |
| Source of Spectrum |
J-53-5452-17 |
| Synonyms |
{5-[6-(benzyloxy)-1H-indol-2-yl]-1H-imidazol-2-yl}(1H-indol-3-yl)methanone |
| Wiley ID |
1382430 |
