| SpectraBase Compound ID | KfGaF4wbIPU |
|---|---|
| InChI | InChI=1S/C16H18N3S.ClH.2H2O/c1-18(2)11-5-7-13-15(9-11)20-16-10-12(19(3)4)6-8-14(16)17-13;;;/h5-10H,1-4H3;1H;2*1H2/q+1;;;/p-1 |
| InChIKey | ULEZOVPNGWYYGH-UHFFFAOYSA-M |
| Mol Weight | 355.88 g/mol |
| Molecular Formula | C16H22ClN3O2S |
| Exact Mass | 355.112126 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Hug4rZdYtg2 |
|---|---|
| Name | C.I. Basic Blue 9, dihydrate |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H22ClN3O2S |
| InChI | InChI=1S/C16H18N3S.ClH.2H2O/c1-18(2)11-5-7-13-15(9-11)20-16-10-12(19(3)4)6-8-14(16)17-13;;;/h5-10H,1-4H3;1H;2*1H2/q+1;;;/p-1 |
| InChIKey | ULEZOVPNGWYYGH-UHFFFAOYSA-M |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 43548M |
| Solvent | D2O |