| SpectraBase Compound ID | 152OEV3SO7q |
|---|---|
| InChI | InChI=1S/C5H10N2.ClHO4/c1-6-4-3-5-7-2;2-1(3,4)5/h3-6H,1-2H3;(H,2,3,4,5)/b4-3+,7-5+; |
| InChIKey | CSSMYPGJZXUDQE-MNJOFHDZSA-N |
| Mol Weight | 198.61 g/mol |
| Molecular Formula | C5H11ClN2O4 |
| Exact Mass | 198.040735 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9DGwkBlINOi |
|---|---|
| Name | 1,5-DIMETHYL-1,5-DIAZAPENTA-1,3-DIENIUM-PERCHLORATE;(E,E)-ISOMER |
| Compound Number | 4B |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C5H10N2.ClHO4/c1-6-4-3-5-7-2;2-1(3,4)5/h3-6H,1-2H3;(H,2,3,4,5)/b4-3+,7-5+; |
| InChIKey | CSSMYPGJZXUDQE-MNJOFHDZSA-N |
| Literature Reference | J.ALCAZAR,I.ALMENA,M.BEGTRUP,A.DELAHOZ J.CHEM.SOC.PERKIN-1,2773(1995) |
| Solvent | Dimethyl sulfoxide-d6 |