| SpectraBase Compound ID | BeauNexXFUW |
|---|---|
| InChI | InChI=1S/C20H29ClO2/c1-18-9-8-16(22)17(21)15(18)5-4-12-13(18)6-10-19(2)14(12)7-11-20(19,3)23/h12-14,23H,4-11H2,1-3H3/t12-,13+,14+,18-,19+,20+/m1/s1 |
| InChIKey | SOMOGWLYTLQJGT-XMUHMHRVSA-N |
| Mol Weight | 336.9 g/mol |
| Molecular Formula | C20H29ClO2 |
| Exact Mass | 336.185608 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HnqbUd5VLMR |
|---|---|
| Name | Methylclostebol |
| Catalog Number | 22448 |
| CAS Registry Number | 5785-58-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H29ClO2 |
| InChI | InChI=1S/C20H29ClO2/c1-18-9-8-16(22)17(21)15(18)5-4-12-13(18)6-10-19(2)14(12)7-11-20(19,3)23/h12-14,23H,4-11H2,1-3H3/t12-,13+,14+,18-,19+,20+/m1/s1 |
| InChIKey | SOMOGWLYTLQJGT-XMUHMHRVSA-N |
| Molecular Weight | 336.903 g/mol |
| SMILES | O[C@]1(CC[C@]2([C@@]3(CCC4=C(C(CC[C@@]4([C@]3(CC[C@]12C)[H])C)=O)Cl)[H])[H])C |
| SPLASH | splash10-0006-5931000000-5052a9097a4b98df48c0 |
| Source of Spectrum | CAY-2023-515-0 |
| Wiley ID | 1888476 |