| SpectraBase Compound ID | CqsQ14LsH79 |
|---|---|
| InChI | InChI=1S/C14H23N/c1-4-5-6-7-15-11-14-9-12(2)8-13(3)10-14/h8-10,15H,4-7,11H2,1-3H3 |
| InChIKey | GNSDTCHEVBTUNJ-UHFFFAOYSA-N |
| Mol Weight | 205.34 g/mol |
| Molecular Formula | C14H23N |
| Exact Mass | 205.18305 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | ErmekaAMoVQ |
|---|---|
| Name | 3,5-Dimethylbenzylpentylamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 205.183049745 u |
| Formula | C14H23N |
| InChI | InChI=1S/C14H23N/c1-4-5-6-7-15-11-14-9-12(2)8-13(3)10-14/h8-10,15H,4-7,11H2,1-3H3 |
| InChIKey | GNSDTCHEVBTUNJ-UHFFFAOYSA-N |
| Molecular Weight | 205.345 g/mol |
| SMILES | C1(=CC(=CC(CNCCCCC)=C1)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.823333 |