SpectraBase Compound ID | xrLCteWtDA |
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InChI | InChI=1S/C20H23Cl3N2O2S/c1-14(20(21,22)23)11-16(27-3)13-18(26)25(2)17(19-24-9-10-28-19)12-15-7-5-4-6-8-15/h4-10,13-14,17H,11-12H2,1-3H3/b16-13+ |
InChIKey | UGNRFJOMRFTXSQ-DTQAZKPQSA-N |
Mol Weight | 461.84 g/mol |
Molecular Formula | C20H23Cl3N2O2S |
Exact Mass | 460.054582 g/mol |
SpectraBase Spectrum ID | BDa88nsS76e |
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Name | BARBAMIDE |
Compound Number | 1 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C20H23Cl3N2O2S |
InChI | InChI=1S/C20H23Cl3N2O2S/c1-14(20(21,22)23)11-16(27-3)13-18(26)25(2)17(19-24-9-10-28-19)12-15-7-5-4-6-8-15/h4-10,13-14,17H,11-12H2,1-3H3/b16-13+ |
InChIKey | UGNRFJOMRFTXSQ-DTQAZKPQSA-N |
Literature Reference Author | J.ORJALA,W.H.GERWICK |
Literature Reference Citation | J.NAT.PROD.,59,427(1996) |
Literature Reference DOI | 10.1021/np960085a |
Molecular Weight | 461.834 g/mol |
Solvent | DMSO-D6 |
Source File Reference | UWVP2456 |