| SpectraBase Compound ID | 9PHk7ifmxiQ |
|---|---|
| InChI | InChI=1S/C23H37NO4S/c1-15(2)18-9-11-22(5,26)14-19(27-17(4)25)13-16(3)7-8-20-23(6,12-10-18)29-21(24)28-20/h9,11,13,15,18-20,24,26H,7-8,10,12,14H2,1-6H3/b11-9+,16-13+,24-21?/t18-,19-,20+,22+,23+/m0/s1 |
| InChIKey | DETHKBIMUIMKST-BAWNPWENSA-N |
| Mol Weight | 423.6 g/mol |
| Molecular Formula | C23H37NO4S |
| Exact Mass | 423.24433 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2DDSmJ1V9VW |
|---|---|
| Name | 1,3-OXATHIOLAN-2-IMINE |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C23H37NO4S |
| InChI | InChI=1S/C23H37NO4S/c1-15(2)18-9-11-22(5,26)14-19(27-17(4)25)13-16(3)7-8-20-23(6,12-10-18)29-21(24)28-20/h9,11,13,15,18-20,24,26H,7-8,10,12,14H2,1-6H3/b11-9+,16-13+,24-21?/t18-,19-,20+,22+,23+/m0/s1 |
| InChIKey | DETHKBIMUIMKST-BAWNPWENSA-N |
| Literature Reference Author | K.A.ELSAYED,S.LAPHOOKHIEO,M.YOUSAF,J.A.PRESTRIDGE,A.B.SHIROD E,V.B.WALI,P.W.SYLVE |
| Literature Reference Citation | J.NAT.PROD.,71,117(2008) |
| Literature Reference DOI | 10.1021/np0704351 |
| Molecular Weight | 423.611 g/mol |
| Sample ID | 27256 |
| Solvent | CDCl3 |