| SpectraBase Compound ID | Jh2ir1wa5OB |
|---|---|
| InChI | InChI=1S/C11H14N2/c1-3-13(8-7-12)11-6-4-5-10(2)9-11/h4-6,9H,3,8H2,1-2H3 |
| InChIKey | XLAYCZJJQWGFAZ-UHFFFAOYSA-N |
| Mol Weight | 174.25 g/mol |
| Molecular Formula | C11H14N2 |
| Exact Mass | 174.115698 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GZqR1Yri0Vz |
|---|---|
| Name | 2-(Ethyl(3-methylphenyl)amino)acetonitrile |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 174.115698459 u |
| Formula | C11H14N2 |
| InChI | InChI=1S/C11H14N2/c1-3-13(8-7-12)11-6-4-5-10(2)9-11/h4-6,9H,3,8H2,1-2H3 |
| InChIKey | XLAYCZJJQWGFAZ-UHFFFAOYSA-N |
| Molecular Weight | 174.247 g/mol |
| SMILES | C(CN(C=1C=C(C=CC1)C)CC)#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.819992 |