![3-{[1,1-dimethyl-3-(5-pyrimidinyl)-2-propynyl]oxy}propionitrile](/api/spectrum/CliSAbmuo2h/structure.png?h=300&w=458 "3-{[1,1-dimethyl-3-(5-pyrimidinyl)-2-propynyl]oxy}propionitrile")
| SpectraBase Compound ID | GzY3ViRIxfL |
|---|---|
| InChI | InChI=1S/C12H13N3O/c1-12(2,16-7-3-6-13)5-4-11-8-14-10-15-9-11/h8-10H,3,7H2,1-2H3 |
| InChIKey | OCILTSQNMAXJIX-UHFFFAOYSA-N |
| Mol Weight | 215.26 g/mol |
| Molecular Formula | C12H13N3O |
| Exact Mass | 215.105862 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CliSAbmuo2h |
|---|---|
| Name | 3-{[1,1-dimethyl-3-(5-pyrimidinyl)-2-propynyl]oxy}propionitrile |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H13N3O |
| InChI | InChI=1S/C12H13N3O/c1-12(2,16-7-3-6-13)5-4-11-8-14-10-15-9-11/h8-10H,3,7H2,1-2H3 |
| InChIKey | OCILTSQNMAXJIX-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 56111M |
| Solvent | CDCl3 |