| SpectraBase Compound ID | 315KdLkNR94 |
|---|---|
| InChI | InChI=1S/C12H13NO/c1-10-5-7-11(8-6-10)12(14)4-2-3-9-13/h5-8H,2-4H2,1H3 |
| InChIKey | ONYGGMPQUGWDMY-UHFFFAOYSA-N |
| Mol Weight | 187.24 g/mol |
| Molecular Formula | C12H13NO |
| Exact Mass | 187.099714 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 | 4X0yiCKN7Co |
|---|---|
| Name | 5-Oxo-5-(p-tolyl)pentanenitrile |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H13NO |
| InChI | InChI=1S/C12H13NO/c1-10-5-7-11(8-6-10)12(14)4-2-3-9-13/h5-8H,2-4H2,1H3 |
| InChIKey | ONYGGMPQUGWDMY-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1002/anie.201204469 |
| Molecular Weight | 187.242 g/mol |
| SMILES | c1c(C(CCCC#N)=O)ccc(c1)C |
| SPLASH | splash10-014i-2900000000-d965dfd770082fb10ee9 |
| Source of Spectrum | ACI-51-SM7-1b |
| Wiley ID | 1780617 |