| SpectraBase Compound ID | DQVFzjgSFnM |
|---|---|
| InChI | InChI=1S/C48H77NO6/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34-38-46(50)53-41-44(42-54-48(52)45(49)40-43-36-32-31-33-37-43)55-47(51)39-35-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h12,14,17-20,31-33,36-37,40,44H,3-11,13,15-16,21-30,34-35,38-39,41-42,49H2,1-2H3/b14-12+,19-17+,20-18+,45-40-/t44-/m1/s1 |
| InChIKey | HABDKLSLUPBHKA-HMSZMONSSA-N |
| Mol Weight | 764.1 g/mol |
| Molecular Formula | C48H77NO6 |
| Exact Mass | 763.575089 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | IWPEVW7u1Nb |
|---|---|
| Name | Dorsamin-A763 |
| Appearance | Colorless oil |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C48H77NO6 |
| InChI | InChI=1S/C48H77NO6/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34-38-46(50)53-41-44(42-54-48(52)45(49)40-43-36-32-31-33-37-43)55-47(51)39-35-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h12,14,17-20,31-33,36-37,40,44H,3-11,13,15-16,21-30,34-35,38-39,41-42,49H2,1-2H3/b14-12+,19-17+,20-18+,45-40-/t44-/m1/s1 |
| InChIKey | HABDKLSLUPBHKA-HMSZMONSSA-N |
| Instrument Name | Shimadzu GCMS-QP2010 Plus |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np300713c |
| Molecular Weight | 764.145 g/mol |
| Reported Formula | C48H78NO6 |
| SMILES | N\C(=C/c1ccccc1)C(OC[C@@](COC(CCCCCCC\C=C\CCCCCCCC)=O)(OC(=O)CCCCCCC\C=C\C\C=C\CCCCC)[H])=O |
| SPLASH | splash10-0a4i-9030002000-f690332b86d8619a925e |
| Source of Spectrum | G4-76-556-1 |
| Wiley ID | 1854896 |