![tert-Butyl (S)-{5-Amino-6-[(2,2-diphenylethyl)amino]-6- oxohexyl}carbamate](/api/spectrum/7TSkXxzvC3F/structure.png?h=300&w=458 "tert-Butyl (S)-{5-Amino-6-[(2,2-diphenylethyl)amino]-6- oxohexyl}carbamate")
| SpectraBase Compound ID | CSvuLMehggK |
|---|---|
| InChI | InChI=1S/C25H35N3O3/c1-25(2,3)31-24(30)27-17-11-10-16-22(26)23(29)28-18-21(19-12-6-4-7-13-19)20-14-8-5-9-15-20/h4-9,12-15,21-22H,10-11,16-18,26H2,1-3H3,(H,27,30)(H,28,29)/t22-/m0/s1 |
| InChIKey | IVLJLFFRQWUGQR-QFIPXVFZSA-N |
| Mol Weight | 425.6 g/mol |
| Molecular Formula | C25H35N3O3 |
| Exact Mass | 425.267842 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7TSkXxzvC3F |
|---|---|
| Name | tert-Butyl (S)-{5-Amino-6-[(2,2-diphenylethyl)amino]-6- oxohexyl}carbamate |
| Appearance | Yellow oil |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H35N3O3 |
| InChI | InChI=1S/C25H35N3O3/c1-25(2,3)31-24(30)27-17-11-10-16-22(26)23(29)28-18-21(19-12-6-4-7-13-19)20-14-8-5-9-15-20/h4-9,12-15,21-22H,10-11,16-18,26H2,1-3H3,(H,27,30)(H,28,29)/t22-/m0/s1 |
| InChIKey | IVLJLFFRQWUGQR-QFIPXVFZSA-N |
| Instrument Name | JEOL JMS-GC Mate II |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/acs.jmedchem.5b01965 |
| Molecular Weight | 425.573 g/mol |
| SMILES | N(C(OC(C)(C)C)=O)CCCC[C@@](C(NCC(c1ccccc1)c1ccccc1)=O)(N)[H] |
| SPLASH | splash10-001i-9620000000-9028788376359fb336ac |
| Source of Spectrum | AF-59-2238-38 |
| Wiley ID | 1843806 |