| SpectraBase Compound ID | BLo1O4GOLTB |
|---|---|
| InChI | InChI=1S/C8H6N2O2/c9-3-5-12-8(11)7-2-1-4-10-6-7/h1-2,4,6H,5H2 |
| InChIKey | PPNCJJLLRMIDII-UHFFFAOYSA-N |
| Mol Weight | 162.15 g/mol |
| Molecular Formula | C8H6N2O2 |
| Exact Mass | 162.042927 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AEoeerWrbh8 |
|---|---|
| Name | nicotinic acid, cyanomethyl ester |
| Source of Sample | S. Grudzinski, Academy of Medicine, Lodz, Poland |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H6N2O2 |
| InChI | InChI=1S/C8H6N2O2/c9-3-5-12-8(11)7-2-1-4-10-6-7/h1-2,4,6H,5H2 |
| InChIKey | PPNCJJLLRMIDII-UHFFFAOYSA-N |
| Instrument Name | Varian A-60 |
| Sadtler NMR Number | 5924M |
| Solvent | CDCl3 |