| SpectraBase Compound ID | KnfblOiGCpV |
|---|---|
| InChI | InChI=1S/C12H13N4O4S.ClH/c1-12(2,3)11-7-21-14(13-11)9-5-4-8(15(17)18)6-10(9)16(19)20;/h4-7H,1-3H3;1H/q+1;/p-1 |
| InChIKey | HBFLJZVJUJHCJE-UHFFFAOYSA-M |
| Mol Weight | 344.77 g/mol |
| Molecular Formula | C12H13ClN4O4S |
| Exact Mass | 344.034604 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4vIXf10SbNo |
|---|---|
| Name | 2-(2,4-DINITROPHENYL)-4-tert-BUTYL-1,2,3-THIADIAZOLIUM-CHLORIDE |
| Compound Number | 4E |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C12H13N4O4S.ClH/c1-12(2,3)11-7-21-14(13-11)9-5-4-8(15(17)18)6-10(9)16(19)20;/h4-7H,1-3H3;1H/q+1;/p-1 |
| InChIKey | HBFLJZVJUJHCJE-UHFFFAOYSA-M |
| Literature Reference | G.LABBE,P.VOSSEN,W.DEHAEN,S.TOPPET J.CHEM.SOC.PERKIN-1,2079(1995) |
| Solvent | Dichloromethane-d2 |