| SpectraBase Compound ID | CPuru8itA31 |
|---|---|
| InChI | InChI=1S/C14H20Cl3NO2P2S/c1-8-5-10-13-11(9(2)6-21(13,19)18(3)4)12(8)22(10,23)20-7-14(15,16)17/h5-6,10-13H,7H2,1-4H3/t10-,11-,12+,13-,21?,22-/m0/s1 |
| InChIKey | LDHDJYZCOSOEAY-GYCNUHKOSA-N |
| Mol Weight | 434.69 g/mol |
| Molecular Formula | C14H20Cl3NO2P2S |
| Exact Mass | 432.975557 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HtbfKhmoQvE |
|---|---|
| Name | LDHDJYZCOSOEAY-GYCNUHKOSA-N |
| Compound Number | 29 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C14H20Cl3NO2P2S |
| InChI | InChI=1S/C14H20Cl3NO2P2S/c1-8-5-10-13-11(9(2)6-21(13,19)18(3)4)12(8)22(10,23)20-7-14(15,16)17/h5-6,10-13H,7H2,1-4H3/t10-,11-,12+,13-,21?,22-/m0/s1 |
| InChIKey | LDHDJYZCOSOEAY-GYCNUHKOSA-N |
| Literature Reference Author | J.SZEWCZYK,L.D.QUIN |
| Literature Reference Citation | J.ORG.CHEM.,52,1190(1987) |
| Literature Reference DOI | 10.1021/jo00383a003 |
| Solvent | CDCl3 |
| Source File Reference | UWSF47 |