| SpectraBase Compound ID | HvOr9VNfizd |
|---|---|
| InChI | InChI=1S/C22H33N2O2S/c1-14(2)17-9-12-22(5,26-17)16-7-10-20(3,24-13-27)15-8-11-21(4,25)19(23-6)18(15)16/h6,15-19,25H,1,7-12H2,2-5H3/q+1/t15-,16-,17-,18-,19+,20-,21+,22+/m1/s1 |
| InChIKey | UEFBYHGZOHSFGO-GUIKRPJLSA-N |
| Mol Weight | 389.6 g/mol |
| Molecular Formula | C22H33N2O2S |
| Exact Mass | 389.226274 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Jm2cpJHDTlB |
|---|---|
| Name | 10-ISOTHIOCYANOTOKALIHINOL-C |
| Compound Number | 14 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H33N2O2S |
| InChI | InChI=1S/C22H33N2O2S/c1-14(2)17-9-12-22(5,26-17)16-7-10-20(3,24-13-27)15-8-11-21(4,25)19(23-6)18(15)16/h6,15-19,25H,1,7-12H2,2-5H3/q+1/t15-,16-,17-,18-,19+,20-,21+,22+/m1/s1 |
| InChIKey | UEFBYHGZOHSFGO-GUIKRPJLSA-N |
| Literature Reference Author | D.WOLF,F.J.SCHMITZ |
| Literature Reference Citation | J.NAT.PROD.,61,1524(1998) |
| Literature Reference DOI | 10.1021/np980240g |
| Molecular Weight | 389.576 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWGE1217 |