![7-chloro-1,3-dihydro-3-[2-(methylthio)ethyl]-5-phenyl-2H-1,4-benzodiazepin-2-one](/api/spectrum/JTnu0mxi7GB/structure.png?h=300&w=458 "7-chloro-1,3-dihydro-3-[2-(methylthio)ethyl]-5-phenyl-2H-1,4-benzodiazepin-2-one")
| SpectraBase Compound ID | 3sA9t1WO6jO |
|---|---|
| InChI | InChI=1S/C18H17ClN2OS/c1-23-10-9-16-18(22)21-15-8-7-13(19)11-14(15)17(20-16)12-5-3-2-4-6-12/h2-8,11,16H,9-10H2,1H3,(H,21,22) |
| InChIKey | MQQRQSSWHIIUMR-UHFFFAOYSA-N |
| Mol Weight | 344.86 g/mol |
| Molecular Formula | C18H17ClN2OS |
| Exact Mass | 344.075012 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JTnu0mxi7GB |
|---|---|
| Name | 7-chloro-1,3-dihydro-3-[2-(methylthio)ethyl]-5-phenyl-2H-1,4-benzodiazepin-2-one |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H17ClN2OS |
| InChI | InChI=1S/C18H17ClN2OS/c1-23-10-9-16-18(22)21-15-8-7-13(19)11-14(15)17(20-16)12-5-3-2-4-6-12/h2-8,11,16H,9-10H2,1H3,(H,21,22) |
| InChIKey | MQQRQSSWHIIUMR-UHFFFAOYSA-N |
| Instrument Name | Varian A-60 |
| Sadtler NMR Number | 9543M |
| Solvent | DMSO-d6 |