| SpectraBase Compound ID | 6NZz4HbPMme |
|---|---|
| InChI | InChI=1S/C27H40N4O4/c1-5-6-17-31-23(24(32)29-20-15-11-8-12-16-20)22(19-13-9-7-10-14-19)28-18-21(25(31)33)30-26(34)35-27(2,3)4/h7,9-10,13-14,20-21,28H,5-6,8,11-12,15-18H2,1-4H3,(H,29,32)(H,30,34)/t21-/m0/s1 |
| InChIKey | OEMWAHSOAOIASY-NRFANRHFSA-N |
| Mol Weight | 484.6 g/mol |
| Molecular Formula | C27H40N4O4 |
| Exact Mass | 484.304956 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5j7EsNEueE7 |
|---|---|
| Name | N-Cyclohexyl 4-n-butyl-2-phenyl-5-oxo-(S)-6-(tert-butoxycarbonylamino)-4,5,6,7-tetrahydro-1H-1,4-diazepine-3-carboxamide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H40N4O4 |
| InChI | InChI=1S/C27H40N4O4/c1-5-6-17-31-23(24(32)29-20-15-11-8-12-16-20)22(19-13-9-7-10-14-19)28-18-21(25(31)33)30-26(34)35-27(2,3)4/h7,9-10,13-14,20-21,28H,5-6,8,11-12,15-18H2,1-4H3,(H,29,32)(H,30,34)/t21-/m0/s1 |
| InChIKey | OEMWAHSOAOIASY-NRFANRHFSA-N |
| Molecular Weight | 484.641 g/mol |
| SMILES | N(C(OC(C)(C)C)=O)[C@@]1(C(N(C(=C(NC1)c1ccccc1)C(NC1CCCCC1)=O)CCCC)=O)[H] |
| SPLASH | splash10-001i-4740900000-cef4c42a0dc93c59b711 |
| Source of Spectrum | F-66-6786-6f |
| Wiley ID | 1684238 |