| SpectraBase Compound ID | 4gePf1ut0cd |
|---|---|
| InChI | InChI=1S/C13H19N/c1-11(14-10-13-7-8-13)9-12-5-3-2-4-6-12/h2-6,11,13-14H,7-10H2,1H3 |
| InChIKey | BYCDOXVZUHPDPT-UHFFFAOYSA-N |
| Mol Weight | 189.3 g/mol |
| Molecular Formula | C13H19N |
| Exact Mass | 189.15175 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | F8TvyIevFtj |
|---|---|
| Name | N-Cyclopropylmethylamphetamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 189.151749616 u |
| Formula | C13H19N |
| InChI | InChI=1S/C13H19N/c1-11(14-10-13-7-8-13)9-12-5-3-2-4-6-12/h2-6,11,13-14H,7-10H2,1H3 |
| InChIKey | BYCDOXVZUHPDPT-UHFFFAOYSA-N |
| Molecular Weight | 189.302 g/mol |
| SMILES | C1(CC(NCC2CC2)C)=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.808089 |