![7,8-dihydro-4-methoxy-6-methyl-1,3-dioxolo[4,5-g]isoguinolinium chloride, dihydrate](/api/spectrum/93ECLkwedfC/structure.png?h=300&w=458 "7,8-dihydro-4-methoxy-6-methyl-1,3-dioxolo[4,5-g]isoguinolinium chloride, dihydrate")
| SpectraBase Compound ID | 9BKCXkjYqWs |
|---|---|
| InChI | InChI=1S/C12H14NO3.ClH.2H2O/c1-13-4-3-8-5-10-12(16-7-15-10)11(14-2)9(8)6-13;;;/h5-6H,3-4,7H2,1-2H3;1H;2*1H2/q+1;;;/p-1 |
| InChIKey | ZKHNRYUDNNPMTB-UHFFFAOYSA-M |
| Mol Weight | 291.73 g/mol |
| Molecular Formula | C12H18ClNO5 |
| Exact Mass | 291.08735 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 93ECLkwedfC |
|---|---|
| Name | 7,8-dihydro-4-methoxy-6-methyl-1,3-dioxolo[4,5-g]isoguinolinium chloride, dihydrate |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H18ClNO5 |
| InChI | InChI=1S/C12H14NO3.ClH.2H2O/c1-13-4-3-8-5-10-12(16-7-15-10)11(14-2)9(8)6-13;;;/h5-6H,3-4,7H2,1-2H3;1H;2*1H2/q+1;;;/p-1 |
| InChIKey | ZKHNRYUDNNPMTB-UHFFFAOYSA-M |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 31240M |
| Solvent | Polysol |