![2-Decanoylamino-4-(methyl-{3-[5-methyl-2-phenyloxazole-4-carbonyl]-ethyl}-carbamoyl)-butyric acid benzyl ester](/api/spectrum/GE7T6FWyV9M/structure.png?h=300&w=458 "2-Decanoylamino-4-(methyl-{3-[5-methyl-2-phenyloxazole-4-carbonyl]-ethyl}-carbamoyl)-butyric acid benzyl ester")
| SpectraBase Compound ID | LKkcPF5ueLe |
|---|---|
| InChI | InChI=1S/C36H48N4O6/c1-4-5-6-7-8-9-16-21-31(41)38-30(36(44)45-26-28-17-12-10-13-18-28)22-23-32(42)40(3)25-24-37-34(43)33-27(2)46-35(39-33)29-19-14-11-15-20-29/h10-15,17-20,30H,4-9,16,21-26H2,1-3H3,(H,37,43)(H,38,41) |
| InChIKey | KQJSZFWOGNBCMT-UHFFFAOYSA-N |
| Mol Weight | 632.8 g/mol |
| Molecular Formula | C36H48N4O6 |
| Exact Mass | 632.357385 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GE7T6FWyV9M |
|---|---|
| Name | 2-Decanoylamino-4-(methyl-{3-[5-methyl-2-phenyloxazole-4-carbonyl]-ethyl}-carbamoyl)-butyric acid benzyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C36H48N4O6 |
| InChI | InChI=1S/C36H48N4O6/c1-4-5-6-7-8-9-16-21-31(41)38-30(36(44)45-26-28-17-12-10-13-18-28)22-23-32(42)40(3)25-24-37-34(43)33-27(2)46-35(39-33)29-19-14-11-15-20-29/h10-15,17-20,30H,4-9,16,21-26H2,1-3H3,(H,37,43)(H,38,41) |
| InChIKey | KQJSZFWOGNBCMT-UHFFFAOYSA-N |
| Molecular Weight | 632.802 g/mol |
| SMILES | N(C(c1nc(-c2ccccc2)oc1C)=O)CCN(C(CCC(C(OCc1ccccc1)=O)NC(=O)CCCCCCCCC)=O)C |
| SPLASH | splash10-007x-9651205000-7cfbaa45abfa2f9432ce |
| Source of Spectrum | G2-5-173-2 |
| Wiley ID | 1714923 |