![(-)-2-[(alpha-methylbenzyl)amino]propionitrile, hydrochloride](/api/spectrum/9sVLd2lzuOw/structure.png?h=300&w=458 "(-)-2-[(alpha-methylbenzyl)amino]propionitrile, hydrochloride")
| SpectraBase Compound ID | I9qpk5GixUG |
|---|---|
| InChI | InChI=1S/C11H14N2.ClH/c1-9(8-12)13-10(2)11-6-4-3-5-7-11;/h3-7,9-10,13H,1-2H3;1H |
| InChIKey | HOPCWOXALBMYDD-UHFFFAOYSA-N |
| Mol Weight | 210.71 g/mol |
| Molecular Formula | C11H15ClN2 |
| Exact Mass | 210.092376 g/mol |
Raman Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9sVLd2lzuOw |
|---|---|
| Name | (-)-2-[(alpha-methylbenzyl)amino]propionitrile, hydrochloride |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.092376191 u |
| Formula | C11H15ClN2 |
| InChI | InChI=1S/C11H14N2.ClH/c1-9(8-12)13-10(2)11-6-4-3-5-7-11;/h3-7,9-10,13H,1-2H3;1H |
| InChIKey | HOPCWOXALBMYDD-UHFFFAOYSA-N |
| SMILES | [Cl-].[NH2+](C(C1=CC=CC=C1)C)C(C#N)C |
| Spectrum/Structure Validation Score (Raman) | 0.731832 |