| SpectraBase Compound ID | 1Nk4JgBqyRd |
|---|---|
| InChI | InChI=1S/C21H34O5/c1-3-4-13-21(2,26)14-9-11-17-16(18(22)15-19(17)23)10-7-5-6-8-12-20(24)25/h5,7,9,11,16-17,19,23,26H,3-4,6,8,10,12-15H2,1-2H3,(H,24,25)/b7-5+,11-9+ |
| InChIKey | XRAJJKTYYUOHNU-JEGFTUTRSA-N |
| Mol Weight | 366.5 g/mol |
| Molecular Formula | C21H34O5 |
| Exact Mass | 366.240624 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3u8XJ6ZdGyT |
|---|---|
| Name | DL-15-Deoxy-16-hydroxy-16-methyl-prostaglandin-E2,epimer-2 |
| CAS Registry Number | 71069-42-6 |
| Comments | broad-band decoupling (BB) |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C21H34O5 |
| InChI | InChI=1S/C21H34O5/c1-3-4-13-21(2,26)14-9-11-17-16(18(22)15-19(17)23)10-7-5-6-8-12-20(24)25/h5,7,9,11,16-17,19,23,26H,3-4,6,8,10,12-15H2,1-2H3,(H,24,25)/b7-5+,11-9+ |
| InChIKey | XRAJJKTYYUOHNU-JEGFTUTRSA-N |
| Instrument Name | SF = 080 MHz |
| Literature Reference | J. Org. Chem. 45, 2278 (1980). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |