| SpectraBase Compound ID | BgCFFv9z1fR |
|---|---|
| InChI | InChI=1S/C25H27N3O4/c1-32-24(31)25(23(27)30,16-18-12-14-19(17-26)15-13-18)28(21-10-6-3-7-11-21)22(29)20-8-4-2-5-9-20/h2,4-5,8-9,12-15,21H,3,6-7,10-11,16H2,1H3,(H2,27,30)/t25-/m0/s1 |
| InChIKey | BDNVQCXCXRGUGH-VWLOTQADSA-N |
| Mol Weight | 433.51 g/mol |
| Molecular Formula | C25H27N3O4 |
| Exact Mass | 433.200156 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IpUnnhJjdDj |
|---|---|
| Name | N-Benzoyl-4-cyano-N-cyclohexyl-.alpha.-(methoxycarbonyl) phenylalaninamide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H27N3O4 |
| InChI | InChI=1S/C25H27N3O4/c1-32-24(31)25(23(27)30,16-18-12-14-19(17-26)15-13-18)28(21-10-6-3-7-11-21)22(29)20-8-4-2-5-9-20/h2,4-5,8-9,12-15,21H,3,6-7,10-11,16H2,1H3,(H2,27,30)/t25-/m0/s1 |
| InChIKey | BDNVQCXCXRGUGH-VWLOTQADSA-N |
| Molecular Weight | 433.508 g/mol |
| SMILES | NC([C@@](N(C1CCCCC1)C(c1ccccc1)=O)(Cc1ccc(cc1)C#N)C(=O)OC)=O |
| SPLASH | splash10-052r-0921000000-3e61f7c52389df1ec71e |
| Source of Spectrum | F-68-8051-7c |
| Wiley ID | 1717595 |