![6-[(p-chlorophenyl)thio]-2,3-dihydro-5,7-dimethyl-1H-1,4-diazepine, monohydrochloride](/api/spectrum/Dv4pCMMOhXi/structure.png?h=300&w=458 "6-[(p-chlorophenyl)thio]-2,3-dihydro-5,7-dimethyl-1H-1,4-diazepine, monohydrochloride")
| SpectraBase Compound ID | 5XPnoVCiPzQ |
|---|---|
| InChI | InChI=1S/C13H15ClN2S.ClH/c1-9-13(10(2)16-8-7-15-9)17-12-5-3-11(14)4-6-12;/h3-6,15H,7-8H2,1-2H3;1H |
| InChIKey | PFPXRVAFJFGSME-UHFFFAOYSA-N |
| Mol Weight | 303.25 g/mol |
| Molecular Formula | C13H16Cl2N2S |
| Exact Mass | 302.041125 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Dv4pCMMOhXi |
|---|---|
| Name | 6-[(p-chlorophenyl)thio]-2,3-dihydro-5,7-dimethyl-1H-1,4-diazepine, monohydrochloride |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H16Cl2N2S |
| InChI | InChI=1S/C13H15ClN2S.ClH/c1-9-13(10(2)16-8-7-15-9)17-12-5-3-11(14)4-6-12;/h3-6,15H,7-8H2,1-2H3;1H |
| InChIKey | PFPXRVAFJFGSME-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 55304M |
| Solvent | Polysol |