| SpectraBase Compound ID | 3XddZW5kRrm |
|---|---|
| InChI | InChI=1S/C10H10ClN/c1-8(5-6-12)9-3-2-4-10(11)7-9/h2-4,7-8H,5H2,1H3 |
| InChIKey | PJMKNRWQZKTBJU-UHFFFAOYSA-N |
| Mol Weight | 179.65 g/mol |
| Molecular Formula | C10H10ClN |
| Exact Mass | 179.050177 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | GUzKlH2zw0b |
|---|---|
| Name | 3-(3-Chlorophenyl)butanenitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H10ClN |
| InChI | InChI=1S/C10H10ClN/c1-8(5-6-12)9-3-2-4-10(11)7-9/h2-4,7-8H,5H2,1H3 |
| InChIKey | PJMKNRWQZKTBJU-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1002/anie.201402053 |
| Molecular Weight | 179.650 g/mol |
| SMILES | c1(cc(C(CC#N)C)ccc1)Cl |
| SPLASH | splash10-000i-0900000000-7ff96733e6e79e8732ec |
| Source of Spectrum | ACI-53-SM41-5i |
| Wiley ID | 1782485 |