| SpectraBase Compound ID | 7NedaeiM608 |
|---|---|
| InChI | InChI=1S/C23H32O5/c1-21-7-5-15(24)10-14(21)3-4-17-18(21)11-19(25)22(2)16(6-8-23(17,22)27)13-9-20(26)28-12-13/h9,14-18,24,27H,3-8,10-12H2,1-2H3/t14-,15+,16-,17-,18+,21+,22+,23+/m1/s1 |
| InChIKey | ZXYZKJDCZKIVKY-DKTASMHOSA-N |
| Mol Weight | 388.5 g/mol |
| Molecular Formula | C23H32O5 |
| Exact Mass | 388.224974 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ESdJDvb9ASy |
|---|---|
| Name | 12-OXO-DIGITOXIGENIN |
| Compound Number | 13 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C23H32O5 |
| InChI | InChI=1S/C23H32O5/c1-21-7-5-15(24)10-14(21)3-4-17-18(21)11-19(25)22(2)16(6-8-23(17,22)27)13-9-20(26)28-12-13/h9,14-18,24,27H,3-8,10-12H2,1-2H3/t14-,15+,16-,17-,18+,21+,22+,23+/m1/s1 |
| InChIKey | ZXYZKJDCZKIVKY-DKTASMHOSA-N |
| Literature Reference Author | K.SHIMADA,H.MASUDA,H.OHTAKI,N.KOBAYASHI,T.NAMBARA |
| Literature Reference Citation | HETEROCYCLES,30,441(1990) |
| Literature Reference DOI | 10.3987/COM-89-S18 |
| Molecular Weight | 388.504 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMK261 |