| SpectraBase Compound ID | AUx5ZDQOU0q |
|---|---|
| InChI | InChI=1S/C8H7N/c1-7-3-2-4-8(5-7)6-9/h2-5H,1H3 |
| InChIKey | BOHCMQZJWOGWTA-UHFFFAOYSA-N |
| Mol Weight | 117.15 g/mol |
| Molecular Formula | C8H7N |
| Exact Mass | 117.057849 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BuZqdVzTYk4 |
|---|---|
| Name | m-TOLUNITRILE |
| Source of Sample | MCB Manufacturing Chemists, Norwood, Ohio |
| Boiling Point | 89-90C/11mm |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H7N |
| InChI | InChI=1S/C8H7N/c1-7-3-2-4-8(5-7)6-9/h2-5H,1H3 |
| InChIKey | BOHCMQZJWOGWTA-UHFFFAOYSA-N |
| Melting Point | -23C |
| Molecular Weight | 117.15 |
| Solvent | Chloroform-d; Reference=TMS Spectrometer= Varian HA-100/Digilab FT-NMR-3 |