| SpectraBase Compound ID | 5fjyDdPsKmp |
|---|---|
| InChI | InChI=1S/C15H23BrO3/c1-13(2)10(16)6-12-15(4,19-13)8-5-11-14(3,18-12)7-9(8)17-11/h8-12H,5-7H2,1-4H3/t8-,9-,10+,11-,12+,14-,15+/m0/s1 |
| InChIKey | FWEJHCOQUTYHDL-PDIQHLCYSA-N |
| Mol Weight | 331.25 g/mol |
| Molecular Formula | C15H23BrO3 |
| Exact Mass | 330.083058 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5gumdm87wCO |
|---|---|
| Name | Aldigenin A |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H23BrO3 |
| InChI | InChI=1S/C15H23BrO3/c1-13(2)10(16)6-12-15(4,19-13)8-5-11-14(3,18-12)7-9(8)17-11/h8-12H,5-7H2,1-4H3/t8-,9-,10+,11-,12+,14-,15+/m0/s1 |
| InChIKey | FWEJHCOQUTYHDL-PDIQHLCYSA-N |
| Molecular Weight | 331.250 g/mol |
| SMILES | [C@]12([C@@]3([C@]4(O[C@@](C3)([C@](O[C@@]1(C[C@@](Br)(C(O2)(C)C)[H])[H])(C)C4)[H])[H])[H])C |
| SPLASH | splash10-0006-9200000000-218a0a449f7710624174 |
| Source of Spectrum | Y1-44-2639-1 |
| Wiley ID | 1621448 |