![5-(Perdeuteriphenylamino)-1-[2'-(perdeuteriophenylamino)-1'-cyanoethyl]-2-cyclopentanone](/api/spectrum/ENc6ddzt3QU/structure.png?h=300&w=458 "5-(Perdeuteriphenylamino)-1-[2'-(perdeuteriophenylamino)-1'-cyanoethyl]-2-cyclopentanone")
| SpectraBase Compound ID | IzwLsZ906SY |
|---|---|
| InChI | InChI=1S/C20H17N3O/c21-13-15(14-22-16-7-3-1-4-8-16)20-18(11-12-19(20)24)23-17-9-5-2-6-10-17/h1-12,14,18,20,22-23H/b15-14+/t18?,20-/m0/s1/i1D,2D,3D,4D,5D,6D,7D,8D,9D,10D/hD2 |
| InChIKey | SALVVMLLQJPRIQ-YLPBXYKHSA-N |
| Mol Weight | 327.45 g/mol |
| Molecular Formula | C20H5D12N3O |
| Exact Mass | 327.212483 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ENc6ddzt3QU |
|---|---|
| Name | 5-(Perdeuteriphenylamino)-1-[2'-(perdeuteriophenylamino)-1'-cyanoethyl]-2-cyclopentanone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H5D12N3O |
| InChI | InChI=1S/C20H17N3O/c21-13-15(14-22-16-7-3-1-4-8-16)20-18(11-12-19(20)24)23-17-9-5-2-6-10-17/h1-12,14,18,20,22-23H/b15-14+/t18?,20-/m0/s1/i1D,2D,3D,4D,5D,6D,7D,8D,9D,10D/hD2 |
| InChIKey | SALVVMLLQJPRIQ-YLPBXYKHSA-N |
| Molecular Weight | 327.449 g/mol |
| SMILES | c1(c(c([D])c(c(c1[D])[D])[D])[D])N(C1[C@](\C(=C\N(c2c(c([D])c(c(c2[D])[D])[D])[D])[D])C#N)(C(=O)C=C1)[H])[D] |
| SPLASH | splash10-003b-9520000000-6b2846ae5dbddc0beb16 |
| Source of Spectrum | G-58-561-0 |
| Synonyms | (S)-5-(Perdeuterophenylamino)-1-[2'-(perdeuterophenylamino)-1'-cyanoethyl]-2-cyclopentanone |
| Wiley ID | 748716 |