SpectraBase Compound ID | 4F7nEm3fD39 |
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InChI | InChI=1S/C10H15N.ClH/c1-11-9-5-8-10-6-3-2-4-7-10;/h2-4,6-7,11H,5,8-9H2,1H3;1H |
InChIKey | XKHCUFJKGWJLNO-UHFFFAOYSA-N |
Mol Weight | 185.7 g/mol |
Molecular Formula | C10H16ClN |
Exact Mass | 185.097127 g/mol |
SpectraBase Spectrum ID | HBy4xcrohIH |
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Name | (3-Phenylpropyl)methylamine HCl |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 185.097127219 u |
Formula | C10H16ClN |
InChI | InChI=1S/C10H15N.ClH/c1-11-9-5-8-10-6-3-2-4-7-10;/h2-4,6-7,11H,5,8-9H2,1H3;1H |
InChIKey | XKHCUFJKGWJLNO-UHFFFAOYSA-N |
SMILES | Cl.N(CCCC1=CC=CC=C1)C |
Spectrum/Structure Validation Score (Raman) | 0.995142 |