![3-(m-nitrophenyl)-5-{[(1,4,5,6-tetrahydro-2-pyrimidinyl)thio]methyl}1,2,4-oxadiazole, monohydrochloride](/api/spectrum/2NnmpZnxDy2/structure.png?h=300&w=458 "3-(m-nitrophenyl)-5-{[(1,4,5,6-tetrahydro-2-pyrimidinyl)thio]methyl}1,2,4-oxadiazole, monohydrochloride")
| SpectraBase Compound ID | Ds1EhRGu65T |
|---|---|
| InChI | InChI=1S/C13H13N5O3S.ClH/c19-18(20)10-4-1-3-9(7-10)12-16-11(21-17-12)8-22-13-14-5-2-6-15-13;/h1,3-4,7H,2,5-6,8H2,(H,14,15);1H |
| InChIKey | XFMOHTCXNVZEFH-UHFFFAOYSA-N |
| Mol Weight | 355.8 g/mol |
| Molecular Formula | C13H14ClN5O3S |
| Exact Mass | 355.050588 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2NnmpZnxDy2 |
|---|---|
| Name | 3-(m-nitrophenyl)-5-{[(1,4,5,6-tetrahydro-2-pyrimidinyl)thio]methyl}1,2,4-oxadiazole, monohydrochloride |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H14ClN5O3S |
| InChI | InChI=1S/C13H13N5O3S.ClH/c19-18(20)10-4-1-3-9(7-10)12-16-11(21-17-12)8-22-13-14-5-2-6-15-13;/h1,3-4,7H,2,5-6,8H2,(H,14,15);1H |
| InChIKey | XFMOHTCXNVZEFH-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 39361M |
| Solvent | Polysol |