| SpectraBase Compound ID | BLPFtfg2aFu |
|---|---|
| InChI | InChI=1S/C11H14ClN/c12-11-5-3-10(4-6-11)8-13-7-9-1-2-9/h3-6,9,13H,1-2,7-8H2 |
| InChIKey | SCYOTFXMCZDRDI-UHFFFAOYSA-N |
| Mol Weight | 195.69 g/mol |
| Molecular Formula | C11H14ClN |
| Exact Mass | 195.081477 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GyRwJCV8Rm2 |
|---|---|
| Name | N-Cyclopropylmethyl-4-chlorobenzylamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 195.081477155 u |
| Formula | C11H14ClN |
| InChI | InChI=1S/C11H14ClN/c12-11-5-3-10(4-6-11)8-13-7-9-1-2-9/h3-6,9,13H,1-2,7-8H2 |
| InChIKey | SCYOTFXMCZDRDI-UHFFFAOYSA-N |
| Molecular Weight | 195.693 g/mol |
| SMILES | C(NCC=1C=CC(=CC1)Cl)C1CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.943175 |