| SpectraBase Compound ID | LhEsAdM8eh5 |
|---|---|
| InChI | InChI=1S/C9H6N2/c10-6-5-8-1-3-9(7-11)4-2-8/h1-4H,5H2/i3D,4D |
| InChIKey | QILKKAFYAFEWGU-NMQOAUCRSA-N |
| Mol Weight | 144.17 g/mol |
| Molecular Formula | C9H4D2N2 |
| Exact Mass | 144.065652 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6wjeBQdus7s |
|---|---|
| Name | 3,5-Dideutero-alpha,4-dicyanotoluene |
| Alternate Name(s) | 3,3-Dideutero-.alpha.,4-dicyanotoluene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H4D2N2 |
| InChI | InChI=1S/C9H6N2/c10-6-5-8-1-3-9(7-11)4-2-8/h1-4H,5H2/i3D,4D |
| InChIKey | QILKKAFYAFEWGU-NMQOAUCRSA-N |
| Molecular Weight | 144.173 g/mol |
| SMILES | C(#N)c1c(cc(cc1[D])CC#N)[D] |
| SPLASH | splash10-00kf-2900000000-9a2d0a17a513f9b08a4f |
| Source of Spectrum | OS-5-257-0 |
| Wiley ID | 82828 |