| SpectraBase Compound ID | KzggEHyUjow |
|---|---|
| InChI | InChI=1S/C12H15N/c13-11-7-2-1-4-8-12-9-5-3-6-10-12/h3,5-6,9-10H,1-2,4,7-8H2 |
| InChIKey | BSJKBXNHLQEFMG-UHFFFAOYSA-N |
| Mol Weight | 173.26 g/mol |
| Molecular Formula | C12H15N |
| Exact Mass | 173.120449 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BWhjG8uwaOA |
|---|---|
| Name | Benzenehexanenitrile |
| CAS Registry Number | 17777-31-0 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H15N |
| InChI | InChI=1S/C12H15N/c13-11-7-2-1-4-8-12-9-5-3-6-10-12/h3,5-6,9-10H,1-2,4,7-8H2 |
| InChIKey | BSJKBXNHLQEFMG-UHFFFAOYSA-N |
| Molecular Weight | 173.259 g/mol |
| SMILES | C(#N)CCCCCc1ccccc1 |
| SPLASH | splash10-0006-9600000000-9cb0b13679ef7222df70 |
| Source of Spectrum | H-57-464-29 |
| Synonyms | 6-Phenylhexanenitrile |
| Wiley ID | 1169928 |