| SpectraBase Compound ID | 2MxIK7ekTte |
|---|---|
| InChI | InChI=1S/C20H32O3/c1-13(2)20(23)9-6-15-14(11-20)16(22)10-17-18(3,12-21)7-5-8-19(15,17)4/h11,13,15,17,21,23H,5-10,12H2,1-4H3/t15-,17-,18-,19+,20+/m0/s1 |
| InChIKey | PMKRDHYIJLQVRT-AEEMCCEDSA-N |
| Mol Weight | 320.5 g/mol |
| Molecular Formula | C20H32O3 |
| Exact Mass | 320.235145 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KQHE9Z4GtQC |
|---|---|
| Name | 13-BETA,18-DIHYDROXYABIET-8(14)-EN-7-ONE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H32O3 |
| InChI | InChI=1S/C20H32O3/c1-13(2)20(23)9-6-15-14(11-20)16(22)10-17-18(3,12-21)7-5-8-19(15,17)4/h11,13,15,17,21,23H,5-10,12H2,1-4H3/t15-,17-,18-,19+,20+/m0/s1 |
| InChIKey | PMKRDHYIJLQVRT-AEEMCCEDSA-N |
| Literature Reference Author | H.OHTSU,R.TANAKA,Y.IN,S.MATSUNAGA,H.TOKUDA,H.NISHINO |
| Literature Reference Citation | CAN.J.CHEM.,78,31(2000) |
| Literature Reference DOI | 10.1139/cjc-78-1-31 |
| Molecular Weight | 320.472 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI542 |