![N'1-(Benzyloxy)-N'4-[1-(hexylcarbamoyl)-2-(1H-indol-3-yl)ethyl]succinamide](/api/spectrum/75avCmFdP6J/structure.png?h=300&w=458 "N'1-(Benzyloxy)-N'4-[1-(hexylcarbamoyl)-2-(1H-indol-3-yl)ethyl]succinamide")
| SpectraBase Compound ID | LoTj8CMxDre |
|---|---|
| InChI | InChI=1S/C28H36N4O4/c1-2-3-4-10-17-29-28(35)25(18-22-19-30-24-14-9-8-13-23(22)24)31-26(33)15-16-27(34)32-36-20-21-11-6-5-7-12-21/h5-9,11-14,19,25,30H,2-4,10,15-18,20H2,1H3,(H,29,35)(H,31,33)(H,32,34) |
| InChIKey | JOAXWISTGKVZJE-UHFFFAOYSA-N |
| Mol Weight | 492.6 g/mol |
| Molecular Formula | C28H36N4O4 |
| Exact Mass | 492.273656 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 75avCmFdP6J |
|---|---|
| Name | N'1-(Benzyloxy)-N'4-[1-(hexylcarbamoyl)-2-(1H-indol-3-yl)ethyl]succinamide |
| Comments | Less than 3 mono-isotopic peaks; Note: The molecular formula of the structure shown is C28H36N4O4 - which differs from the formula reported for the mass spectrum (C21H30N4O3) |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H30N4O3 |
| InChI | InChI=1S/C28H36N4O4/c1-2-3-4-10-17-29-28(35)25(18-22-19-30-24-14-9-8-13-23(22)24)31-26(33)15-16-27(34)32-36-20-21-11-6-5-7-12-21/h5-9,11-14,19,25,30H,2-4,10,15-18,20H2,1H3,(H,29,35)(H,31,33)(H,32,34) |
| InChIKey | JOAXWISTGKVZJE-UHFFFAOYSA-N |
| Molecular Weight | 492.620 g/mol |
| SMILES | N(C(CCC(=O)NOCc1ccccc1)=O)C(C(NCCCCCC)=O)Cc1c[nH]c2ccccc12 |
| SPLASH | splash10-001i-0900000000-283d5ce058245492d734 |
| Source of Spectrum | H1-51-1083-7 |
| Wiley ID | 817149 |