| SpectraBase Compound ID | BqXbtSYnXTx |
|---|---|
| InChI | InChI=1S/C8H12N2/c1-5-3-4-7(9)8(10)6(5)2/h3-4H,9-10H2,1-2H3 |
| InChIKey | MHQULXYNBKWNDF-UHFFFAOYSA-N |
| Mol Weight | 136.2 g/mol |
| Molecular Formula | C8H12N2 |
| Exact Mass | 136.100048 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 65mpjGJRKMa |
|---|---|
| Name | 3,4-Dimethyl-o-phenylenediamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 136.100048394 u |
| Formula | C8H12N2 |
| InChI | InChI=1S/C8H12N2/c1-5-3-4-7(9)8(10)6(5)2/h3-4H,9-10H2,1-2H3 |
| InChIKey | MHQULXYNBKWNDF-UHFFFAOYSA-N |
| Molecular Weight | 136.198 g/mol |
| SMILES | NC1=CC=C(C(=C1N)C)C |
| Spectrum/Structure Validation Score (Raman) | 0.985634 |