| SpectraBase Compound ID | 9l9PNkbpohW |
|---|---|
| InChI | InChI=1S/C12H11N3/c1-15(2)12-5-3-10(4-6-12)7-11(8-13)9-14/h3-7H,1-2H3 |
| InChIKey | IYNONQVNLZATDK-UHFFFAOYSA-N |
| Mol Weight | 197.24 g/mol |
| Molecular Formula | C12H11N3 |
| Exact Mass | 197.095297 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | IUimVrrzMJH |
|---|---|
| Name | [p-(Dimethylamino)benzylidene]malononitrile |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 197.095297366 u |
| Formula | C12H11N3 |
| InChI | InChI=1S/C12H11N3/c1-15(2)12-5-3-10(4-6-12)7-11(8-13)9-14/h3-7H,1-2H3 |
| InChIKey | IYNONQVNLZATDK-UHFFFAOYSA-N |
| Molecular Weight | 197.241 g/mol |
| SMILES | C=1C(=CC=C(C1)C=C(C#N)C#N)N(C)C |
| Spectrum/Structure Validation Score (Raman) | 0.956753 |