| 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 | BvmMq4G6k30 |
|---|---|
| Name | M-Tolunitrile |
| CAS Registry Number | 620-22-4 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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 |
| Instrument Name | Jeol PFT-100 |
| Literature Reference | J. Bromilow, R.T. Brownlee, D.J. Craik, M.Sadek, Magn. Res. Chem. 24, 862 (1986) |
| NMR Standard | CDCl3 |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |