![2-(4-nitrobenzylthio)-3,4-dihydrobenzo[d]pyrimidin-4-one](/api/spectrum/Lk6rLVWqyyH/structure.png?h=300&w=458 "2-(4-nitrobenzylthio)-3,4-dihydrobenzo[d]pyrimidin-4-one")
| SpectraBase Compound ID | Fxy2lqnKK2H |
|---|---|
| InChI | InChI=1S/C15H11N3O3S/c19-14-12-3-1-2-4-13(12)16-15(17-14)22-9-10-5-7-11(8-6-10)18(20)21/h1-8H,9H2,(H,16,17,19) |
| InChIKey | ASHQVUBDHNQTIG-UHFFFAOYSA-N |
| Mol Weight | 313.33 g/mol |
| Molecular Formula | C15H11N3O3S |
| Exact Mass | 313.052112 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | Lk6rLVWqyyH |
|---|---|
| Name | 2-(4-nitrobenzylthio)-3,4-dihydrobenzo[d]pyrimidin-4-one |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C15H11N3O3S |
| InChI | InChI=1S/C15H11N3O3S/c19-14-12-3-1-2-4-13(12)16-15(17-14)22-9-10-5-7-11(8-6-10)18(20)21/h1-8H,9H2,(H,16,17,19) |
| InChIKey | ASHQVUBDHNQTIG-UHFFFAOYSA-N |
| Instrument Name | Bruker AM-300 |
| NMR Standard | DMSO-d5 1H |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | DMSO-d6 |