| SpectraBase Compound ID | KUYSWzdRwC7 |
|---|---|
| InChI | InChI=1S/C21H27NO3/c1-11(22-24)13-4-5-14-17-15(7-9-20(13,14)2)21(3)8-6-12(23)10-16(21)18-19(17)25-18/h6,8,10,13-15,17-19,24H,4-5,7,9H2,1-3H3/b22-11+/t13-,14+,15+,17+,18-,19+,20-,21-/m1/s1 |
| InChIKey | ZERDLIQAPCAFTP-AZFLHKOFSA-N |
| Mol Weight | 341.45 g/mol |
| Molecular Formula | C21H27NO3 |
| Exact Mass | 341.199094 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1gdRC1yfXAC |
|---|---|
| Name | 6-ALPHA,7-ALPHA-EPOXY-PREGNA-1,4-DIENE-3,20-DIONE-20-OXIME |
| Compound Number | 14 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H26NO3 |
| InChI | InChI=1S/C21H27NO3/c1-11(22-24)13-4-5-14-17-15(7-9-20(13,14)2)21(3)8-6-12(23)10-16(21)18-19(17)25-18/h6,8,10,13-15,17-19,24H,4-5,7,9H2,1-3H3/b22-11+/t13-,14+,15+,17+,18-,19+,20-,21-/m1/s1 |
| InChIKey | ZERDLIQAPCAFTP-AZFLHKOFSA-N |
| Literature Reference Author | S.KIM,Y.U.KIM,E.MA |
| Literature Reference Citation | MOLECULES,17,355(2012) |
| Literature Reference DOI | 10.3390/molecules17010355 |
| Molecular Weight | 340.442 g/mol |
| Sample ID | 72946 |
| Solvent | CDCl3 |