![Trans-N-[(2-phenyl-1-cyclopropyl)methyl]ethylamine, hydrochloride](/api/spectrum/Erx8pv4JuoU/structure.png?h=300&w=458 "Trans-N-[(2-phenyl-1-cyclopropyl)methyl]ethylamine, hydrochloride")
| SpectraBase Compound ID | LuhW6hUh2Wb |
|---|---|
| InChI | InChI=1S/C12H17N.ClH/c1-2-13-9-11-8-12(11)10-6-4-3-5-7-10;/h3-7,11-13H,2,8-9H2,1H3;1H/t11-,12-;/m0./s1 InChI=1S/C12H17N.ClH/c1-2-13-9-11-8-12(11)10-6-4-3-5-7-10;/h3-7,11-13H,2,8-9H2,1H3;1H/t11-,12-;/m1./s1 |
| InChIKey | QNXBTMNIIFRNIP-FXMYHANSSA-N |
| Mol Weight | 211.74 g/mol |
| Molecular Formula | C12H18ClN |
| Exact Mass | 211.112777 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | Erx8pv4JuoU |
|---|---|
| Name | Trans-N-[(2-phenyl-1-cyclopropyl)methyl]ethylamine, hydrochloride |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 211.112777284 u |
| Formula | C12H18ClN |
| InChI | InChI=1S/C12H17N.ClH/c1-2-13-9-11-8-12(11)10-6-4-3-5-7-10;/h3-7,11-13H,2,8-9H2,1H3;1H/t11-,12-;/m0./s1 |
| InChIKey | QNXBTMNIIFRNIP-FXMYHANSSA-N |
| SMILES | Cl.N(CC)C[C@]1([C@](C=2C=CC=CC2)(C1)[H])[H] |
| Spectrum/Structure Validation Score (Raman) | 0.92429 |