| SpectraBase Compound ID | DnoAxd4yyx9 |
|---|---|
| InChI | InChI=1S/C21H26O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-15,18,22,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,18+,19-,20-,21-/m0/s1 |
| InChIKey | XOFYZVNMUHMLCC-ZPOLXVRWSA-N |
| Mol Weight | 358.43 g/mol |
| Molecular Formula | C21H26O5 |
| Exact Mass | 358.178024 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2yM3So9r0r7 |
|---|---|
| Name | Prednisone |
| Copyright | Copyright © 2012-2025 John Wiley & Sons, Inc. Portions provided by AAFS, Toxicology Section. All Rights Reserved. |
| Formula | C21H26O5 |
| InChI | InChI=1S/C21H26O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-15,18,22,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,18+,19-,20-,21-/m0/s1 |
| InChIKey | XOFYZVNMUHMLCC-ZPOLXVRWSA-N |
| SMILES | OCC([C@@]1([C@]2(CC([C@@]3([C@]4(C=CC(C=C4CC[C@]3([C@@]2(CC1)[H])[H])=O)C)[H])=O)C)O)=O |
| SPLASH | splash10-006x-7930000000-663414516d46045896da |
| Source of Spectrum | Mass Spectrometry Committee of the Toxicology Section of the American Academy of Forensic Sciences |