| SpectraBase Compound ID | Fbklt4NoWuq |
|---|---|
| InChI | InChI=1S/C27H44O3/c1-15(2)6-9-22-16(3)25-23(30-22)14-21-19-8-7-17-12-18(28)13-24(29)27(17,5)20(19)10-11-26(21,25)4/h7,15-16,18-25,28-29H,6,8-14H2,1-5H3/t16-,18?,19?,20?,21?,22?,23?,24?,25?,26+,27+/m1/s1 |
| InChIKey | YHRVCEOENVRMCE-MZWKXUJISA-N |
| Mol Weight | 416.6 g/mol |
| Molecular Formula | C27H44O3 |
| Exact Mass | 416.329045 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 24vredfReSC |
|---|---|
| Name | Dehydro-allisterol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H44O3 |
| InChI | InChI=1S/C27H44O3/c1-15(2)6-9-22-16(3)25-23(30-22)14-21-19-8-7-17-12-18(28)13-24(29)27(17,5)20(19)10-11-26(21,25)4/h7,15-16,18-25,28-29H,6,8-14H2,1-5H3/t16-,18?,19?,20?,21?,22?,23?,24?,25?,26+,27+/m1/s1 |
| InChIKey | YHRVCEOENVRMCE-MZWKXUJISA-N |
| Molecular Weight | 416.646 g/mol |
| SMILES | OC1CC2=CCC3C4[C@](CCC3[C@]2(C(C1)O)C)(C1C(C4)OC([C@]1(C)[H])CCC(C)C)C |
| SPLASH | splash10-0002-0019000000-1d6dffeef484a6326f41 |
| Source of Spectrum | X4-28-302-0 |
| Wiley ID | 1586475 |