| SpectraBase Compound ID | KRx9fo3z1NE |
|---|---|
| InChI | InChI=1S/C15H14O5/c1-7-12-9-5-8(14(17)18-9)3-4-11-15(2,20-11)6-10(12)19-13(7)16/h3-5,9-12H,1,6H2,2H3/b4-3-/t9-,10+,11-,12?,15+/m1/s1 |
| InChIKey | DRUYMRSAKYIRAE-AXVNEXIPSA-N |
| Mol Weight | 274.27 g/mol |
| Molecular Formula | C15H14O5 |
| Exact Mass | 274.084124 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ISmIXwfRSqc |
|---|---|
| Name | Anhydro-scandenolide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H14O5 |
| InChI | InChI=1S/C15H14O5/c1-7-12-9-5-8(14(17)18-9)3-4-11-15(2,20-11)6-10(12)19-13(7)16/h3-5,9-12H,1,6H2,2H3/b4-3-/t9-,10+,11-,12?,15+/m1/s1 |
| InChIKey | DRUYMRSAKYIRAE-AXVNEXIPSA-N |
| Molecular Weight | 274.272 g/mol |
| SMILES | [C@@]12(O[C@@]2(\C=C/C=2C(=O)O[C@@](C3C(=C)C(O[C@]3(C1)[H])=O)(C2)[H])[H])C |
| SPLASH | splash10-000i-7900000000-bfdcb2b184b9908e27d7 |
| Source of Spectrum | X2-51-626-6 |
| Wiley ID | 1602759 |