| SpectraBase Compound ID | 8XjugaCQJO8 |
|---|---|
| InChI | InChI=1S/C12H15N/c1-2-3-4-7-11-8-5-6-9-12(11)10-13/h5-6,8-9H,2-4,7H2,1H3 |
| InChIKey | LYCALCIJYUIMEO-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 | 1EAS4yRzJwP |
|---|---|
| Name | 2-Pentylbenzonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H15N |
| InChI | InChI=1S/C12H15N/c1-2-3-4-7-11-8-5-6-9-12(11)10-13/h5-6,8-9H,2-4,7H2,1H3 |
| InChIKey | LYCALCIJYUIMEO-UHFFFAOYSA-N |
| Molecular Weight | 173.259 g/mol |
| SMILES | C(#N)c1c(CCCCC)cccc1 |
| SPLASH | splash10-014i-0900000000-54744e5878e137e6db9d |
| Source of Spectrum | SO-0-71-3 |
| Synonyms | 2-Amylbenzonitrile 2-Pentylbenzenecarbonitrile |
| Wiley ID | 872867 |