| SpectraBase Compound ID | LSlrFtQK5ux |
|---|---|
| InChI | InChI=1S/C11H11N/c1-8(2)11-6-4-5-10(7-12)9(11)3/h4-6H,1H2,2-3H3 |
| InChIKey | VNSPSTSJMBFMRH-UHFFFAOYSA-N |
| Mol Weight | 157.22 g/mol |
| Molecular Formula | C11H11N |
| Exact Mass | 157.089149 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FqpUGKtS42l |
|---|---|
| Name | Benzonitrile, 2-methyl-3-(1-methylethenyl)- |
| Alternate Name(s) | 3-Isopropenyl-2-methylbenzonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H11N |
| InChI | InChI=1S/C11H11N/c1-8(2)11-6-4-5-10(7-12)9(11)3/h4-6H,1H2,2-3H3 |
| InChIKey | VNSPSTSJMBFMRH-UHFFFAOYSA-N |
| Molecular Weight | 157.216 g/mol |
| SMILES | C=C(C)c1c(c(ccc1)C#N)C |
| SPLASH | splash10-0aou-3900000000-278e4611b2a318f1b64c |
| Wiley ID | 1471554 |