| SpectraBase Compound ID | 86jnE307sA5 |
|---|---|
| InChI | InChI=1S/C37H56N2O6/c1-5-6-7-8-10-19-26-33(44-36(41)38-29(2)31-22-15-13-16-23-31)34(27-20-11-9-12-21-28-35(40)43-4)45-37(42)39-30(3)32-24-17-14-18-25-32/h13-18,22-25,29-30,33-34H,5-12,19-21,26-28H2,1-4H3,(H,38,41)(H,39,42)/t29-,30-,33+,34-/m0/s1 |
| InChIKey | TZZOTQVDXZUIGX-ZVUWZQQXSA-N |
| Mol Weight | 624.9 g/mol |
| Molecular Formula | C37H56N2O6 |
| Exact Mass | 624.413838 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8YjO758iF0w |
|---|---|
| Name | anti-(-)-(9S/R,10R/S.4'S,4'S)-Methyl 9,10-di(N-1-phenylethylamido)octadecanoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C37H56N2O6 |
| InChI | InChI=1S/C37H56N2O6/c1-5-6-7-8-10-19-26-33(44-36(41)38-29(2)31-22-15-13-16-23-31)34(27-20-11-9-12-21-28-35(40)43-4)45-37(42)39-30(3)32-24-17-14-18-25-32/h13-18,22-25,29-30,33-34H,5-12,19-21,26-28H2,1-4H3,(H,38,41)(H,39,42)/t29-,30-,33+,34-/m0/s1 |
| InChIKey | TZZOTQVDXZUIGX-ZVUWZQQXSA-N |
| Molecular Weight | 624.863 g/mol |
| SMILES | N(C(O[C@]([C@](OC(N[C@](c1ccccc1)(C)[H])=O)(CCCCCCCC)[H])(CCCCCCCC(=O)OC)[H])=O)[C@](c1ccccc1)(C)[H] |
| SPLASH | splash10-0a59-2900000000-136af0e01714be08601d |
| Source of Spectrum | SO-0-1257-7 |
| Wiley ID | 875802 |