| SpectraBase Compound ID | 1qxpJCrSivp |
|---|---|
| InChI | InChI=1S/C10H10ClN/c1-7-3-8(2)10(6-12)4-9(7)5-11/h3-4H,5H2,1-2H3 |
| InChIKey | IHJLPHOXNLGMTI-UHFFFAOYSA-N |
| Mol Weight | 179.65 g/mol |
| Molecular Formula | C10H10ClN |
| Exact Mass | 179.050177 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CHq3cJkEvSw |
|---|---|
| Name | 2,4-Dimethyl-5-chloromethylbenzonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H10ClN |
| InChI | InChI=1S/C10H10ClN/c1-7-3-8(2)10(6-12)4-9(7)5-11/h3-4H,5H2,1-2H3 |
| InChIKey | IHJLPHOXNLGMTI-UHFFFAOYSA-N |
| Molecular Weight | 179.650 g/mol |
| SMILES | c1(C#N)cc(CCl)c(cc1C)C |
| SPLASH | splash10-0006-0900000000-d46b234d33b9a55cb813 |
| Source of Spectrum | O1-32-1455-2 |
| Wiley ID | 819108 |