![N-{1-[3'-Benzoyl-4'-(p-tolylacetylamino)phenylcarbamoyl]-2'-phenylethyl}-3-[(biphenyl-4"-yl)-acrylamide](/api/spectrum/BK7ExsFIgEL/structure.png?h=300&w=458 "N-{1-[3'-Benzoyl-4'-(p-tolylacetylamino)phenylcarbamoyl]-2'-phenylethyl}-3-[(biphenyl-4\"-yl)-acrylamide")
| SpectraBase Compound ID | DzYt2twVuJH |
|---|---|
| InChI | InChI=1S/C46H39N3O4/c1-32-17-19-35(20-18-32)30-44(51)48-41-27-26-39(31-40(41)45(52)38-15-9-4-10-16-38)47-46(53)42(29-34-11-5-2-6-12-34)49-43(50)28-23-33-21-24-37(25-22-33)36-13-7-3-8-14-36/h2-28,31,42H,29-30H2,1H3,(H,47,53)(H,48,51)(H,49,50)/b28-23+ |
| InChIKey | KKLDUIZRJLMGDM-WEMUOSSPSA-N |
| Mol Weight | 697.8 g/mol |
| Molecular Formula | C46H39N3O4 |
| Exact Mass | 697.294057 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | BK7ExsFIgEL |
|---|---|
| Name | N-{1-[3'-Benzoyl-4'-(p-tolylacetylamino)phenylcarbamoyl]-2'-phenylethyl}-3-[(biphenyl-4"-yl)-acrylamide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C46H39N3O4 |
| InChI | InChI=1S/C46H39N3O4/c1-32-17-19-35(20-18-32)30-44(51)48-41-27-26-39(31-40(41)45(52)38-15-9-4-10-16-38)47-46(53)42(29-34-11-5-2-6-12-34)49-43(50)28-23-33-21-24-37(25-22-33)36-13-7-3-8-14-36/h2-28,31,42H,29-30H2,1H3,(H,47,53)(H,48,51)(H,49,50)/b28-23+ |
| InChIKey | KKLDUIZRJLMGDM-WEMUOSSPSA-N |
| Molecular Weight | 697.835 g/mol |
| SMILES | N(c1c(cc(NC(C(NC(\C=C\c2ccc(cc2)-c2ccccc2)=O)Cc2ccccc2)=O)cc1)C(=O)c1ccccc1)C(=O)Cc1ccc(cc1)C |
| SPLASH | splash10-01t9-0434907000-3a4ef5d73ce6d34f5a97 |
| Source of Spectrum | D9-336-248-7 |
| Wiley ID | 1551066 |