| SpectraBase Compound ID | J8fdsjSJrCk |
|---|---|
| InChI | InChI=1S/C12H13NO2/c1-9(2)8-15-12(14)11-5-3-4-10(6-11)7-13/h3-6,9H,8H2,1-2H3 |
| InChIKey | WYLBZEVZADZBKE-UHFFFAOYSA-N |
| Mol Weight | 203.24 g/mol |
| Molecular Formula | C12H13NO2 |
| Exact Mass | 203.094629 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 | Cqpe3M6Vzu7 |
|---|---|
| Name | Isobutyl 3-cyanobenzoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H13NO2 |
| InChI | InChI=1S/C12H13NO2/c1-9(2)8-15-12(14)11-5-3-4-10(6-11)7-13/h3-6,9H,8H2,1-2H3 |
| InChIKey | WYLBZEVZADZBKE-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 203.241 g/mol |
| SMILES | C(#N)c1cccc(c1)C(=O)OCC(C)C |
| SPLASH | splash10-053r-7900000000-e206beb3bd4fa27fd6ff |
| Source of Spectrum | SRH-2022-1791-0 |
| Wiley ID | 1824164 |