| SpectraBase Compound ID | AQ0E01wDFeh |
|---|---|
| InChI | InChI=1S/C8H5NO2/c9-4-6-1-2-7-8(3-6)11-5-10-7/h1-3H,5H2 |
| InChIKey | PKRWWZCDLJSJIF-UHFFFAOYSA-N |
| Mol Weight | 147.13 g/mol |
| Molecular Formula | C8H5NO2 |
| Exact Mass | 147.032028 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GPQkFZPjjje |
|---|---|
| Name | Piperonylonitrile |
| Alternate Name(s) | benzo[d][1,3]dioxole-5-carbonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H5NO2 |
| InChI | InChI=1S/C8H5NO2/c9-4-6-1-2-7-8(3-6)11-5-10-7/h1-3H,5H2 |
| InChIKey | PKRWWZCDLJSJIF-UHFFFAOYSA-N |
| Molecular Weight | 147.133 g/mol |
| SMILES | C(c1cc2OCOc2cc1)#N |
| SPLASH | splash10-0002-1900000000-dc0fadfa75732035cef5 |
| Source of Spectrum | F-71-3800-2_29 |
| Wiley ID | 1805774 |