| SpectraBase Compound ID | KOI8kwFezLD |
|---|---|
| InChI | InChI=1S/C8H7N/c9-7-8-5-3-1-2-4-6-8/h1-6,8H |
| InChIKey | LADCKIXFXIKHQM-UHFFFAOYSA-N |
| Mol Weight | 117.15 g/mol |
| Molecular Formula | C8H7N |
| Exact Mass | 117.057849 g/mol |
Attenuated Total Reflectance Infrared (ATR-IR) Spectrum
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| SpectraBase Spectrum ID | Kgm48ihOcRi |
|---|---|
| Name | 2,4,6-Cycloheptatriene-1-carbonitrile |
| Source of Sample | Aldrich |
| Catalog Number | 393320 |
| CAS Registry Number | 13612-59-4 |
| Copyright | Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H7N |
| InChI | InChI=1S/C8H7N/c9-7-8-5-3-1-2-4-6-8/h1-6,8H |
| InChIKey | LADCKIXFXIKHQM-UHFFFAOYSA-N |
| Purity | 95% |
| Wiley ID | SIAL_ATR-IR_018344 |