| SpectraBase Compound ID | EyNmvboniPF |
|---|---|
| InChI | InChI=1S/C30H50O/c1-20-21(31)9-10-22-27(20,5)12-11-23-28(22,6)16-18-30(8)24-19-25(2,3)13-14-26(24,4)15-17-29(23,30)7/h20,22-24H,9-19H2,1-8H3/t20-,22+,23-,24+,26+,27+,28-,29+,30-/m0/s1 |
| InChIKey | OFMXGFHWLZPCFL-SVRPQWSVSA-N |
| Mol Weight | 426.7 g/mol |
| Molecular Formula | C30H50O |
| Exact Mass | 426.386166 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CdIcX7R0jHD |
|---|---|
| Name | Friedelan-3-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 426.386166229 u |
| Formula | C30H50O |
| InChI | InChI=1S/C30H50O/c1-20-21(31)9-10-22-27(20,5)12-11-23-28(22,6)16-18-30(8)24-19-25(2,3)13-14-26(24,4)15-17-29(23,30)7/h20,22-24H,9-19H2,1-8H3/t20-,22+,23-,24+,26+,27+,28-,29+,30-/m0/s1 |
| InChIKey | OFMXGFHWLZPCFL-SVRPQWSVSA-N |
| Instrument Name | GCMS |
| Ionization Type | EI |
| Literature Reference DOI | 10.1002/cbdv.202201039 |
| Molecular Weight | 426.729 g/mol |
| Quality | 664 |
| SMILES | [C@]12([C@@]([C@@]3([C@]([C@]4([C@@](CC3)(CCC(C4)(C)C)C)[H])(CC2)C)C)(CC[C@]2([C@]1(CCC([C@@]2(C)[H])=O)[H])C)[H])C |
| SPLASH | splash10-05mk-6940000000-cc599f030274a6cafeb9 |
| Source of Spectrum | CBD-20-SM4-2 (DOI: 10.1002/cbdv.202201039) |
| Wiley ID | 1902889 |