| SpectraBase Compound ID | 5SXGqOpeZpf |
|---|---|
| InChI | InChI=1S/C31H50O2/c1-20(2)21-10-13-25-30(7)17-14-22-23(29(30,6)18-19-31(21,25)26(32)33-8)11-12-24-27(3,4)15-9-16-28(22,24)5/h14,20-21,23-25H,9-13,15-19H2,1-8H3/t21-,23-,24?,25?,28-,29-,30+,31+/m1/s1 |
| InChIKey | CONFEXGLHPMZLP-OMNVEDAQSA-N |
| Mol Weight | 454.7 g/mol |
| Molecular Formula | C31H50O2 |
| Exact Mass | 454.381081 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KVmnyIHAgQw |
|---|---|
| Name | Methyl Fern-9(11)-ene-28-oate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C31H50O2 |
| InChI | InChI=1S/C31H50O2/c1-20(2)21-10-13-25-30(7)17-14-22-23(29(30,6)18-19-31(21,25)26(32)33-8)11-12-24-27(3,4)15-9-16-28(22,24)5/h14,20-21,23-25H,9-13,15-19H2,1-8H3/t21-,23-,24?,25?,28-,29-,30+,31+/m1/s1 |
| InChIKey | CONFEXGLHPMZLP-OMNVEDAQSA-N |
| Molecular Weight | 454.739 g/mol |
| SMILES | [C@@]12(C([C@@]3(CC=C4[C@]([C@]3(CC2)C)(CCC2C(CCC[C@]42C)(C)C)[H])C)CC[C@@]1(C(C)C)[H])C(=O)OC |
| SPLASH | splash10-002u-0032900000-adc581ccac6301e4d600 |
| Source of Spectrum | E1-40-1687-0 |
| Wiley ID | 1519574 |