| SpectraBase Compound ID | Hc6qwqSlycO |
|---|---|
| InChI | InChI=1S/C21H32ClNO2/c1-14-5-7-18-17(11-14)16(9-10-21(18,4)23-13-24)15-6-8-19(25-12-15)20(2,3)22/h6,11,13,16-19H,5,7-10,12H2,1-4H3,(H,23,24)/t16-,17+,18+,19?,21+/m0/s1 |
| InChIKey | SQQXPBJEMWEBJP-FQKZQQCXSA-N |
| Mol Weight | 365.9 g/mol |
| Molecular Formula | C21H32ClNO2 |
| Exact Mass | 365.212157 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Gt79effBH7a |
|---|---|
| Name | S-TRANS-KALIHIPYRAN-B |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H32ClNO2 |
| InChI | InChI=1S/C21H32ClNO2/c1-14-5-7-18-17(11-14)16(9-10-21(18,4)23-13-24)15-6-8-19(25-12-15)20(2,3)22/h6,11,13,16-19H,5,7-10,12H2,1-4H3,(H,23,24)/t16-,17+,18+,19?,21+/m0/s1 |
| InChIKey | SQQXPBJEMWEBJP-FQKZQQCXSA-N |
| Literature Reference Author | T.OKINO,E.YOSHIMURA,H.HIROTA,N.FUSETANI |
| Literature Reference Citation | J.NAT.PROD.,59,1081(1996) |
| Literature Reference DOI | 10.1021/np960496r |
| Molecular Weight | 365.944 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVP662 |