| SpectraBase Compound ID | D6XwTLsel1k |
|---|---|
| InChI | InChI=1S/C21H26F2O4S/c1-10-6-12-13-8-15(22)14-7-11(24)4-5-18(14,2)20(13,23)16(25)9-19(12,3)21(10,27)17(26)28/h4-5,7,10,12-13,15-16,25,27H,6,8-9H2,1-3H3,(H,26,28) |
| InChIKey | GLAJUXBOZSWZMM-UHFFFAOYSA-N |
| Mol Weight | 412.49 g/mol |
| Molecular Formula | C21H26F2O4S |
| Exact Mass | 412.151987 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FfVfEX4tS6o |
|---|---|
| Name | ANDROSTA-1,4-DIENE-17-CARBOTHIOIC ACID, 6,9-DIFLUORO-11,17-DIHYDROXY-16-METHYL-3-OXO- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C21H26F2O4S |
| InChI | InChI=1S/C21H26F2O4S/c1-10-6-12-13-8-15(22)14-7-11(24)4-5-18(14,2)20(13,23)16(25)9-19(12,3)21(10,27)17(26)28/h4-5,7,10,12-13,15-16,25,27H,6,8-9H2,1-3H3,(H,26,28) |
| InChIKey | GLAJUXBOZSWZMM-UHFFFAOYSA-N |
| Instrument Name | BRUKER CPX-200 |
| Solvent | DMSO-d6 |