| SpectraBase Compound ID | 7svbxbu8iWQ |
|---|---|
| InChI | InChI=1S/C17H25N/c1-3-7-15-8-5-9-16(13-15)17-10-6-12-18(14-17)11-4-2/h3,5,8-9,13,17H,1,4,6-7,10-12,14H2,2H3/t17-/m1/s1 |
| InChIKey | YCOYVHRSUJTZLM-QGZVFWFLSA-N |
| Mol Weight | 243.39 g/mol |
| Molecular Formula | C17H25N |
| Exact Mass | 243.1987 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8aZ2m1TIaVP |
|---|---|
| Name | (3S)-3-(3-Allylphenyl)-1-propyl-piperidine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 243.198699809 u |
| Formula | C17H25N |
| InChI | InChI=1S/C17H25N/c1-3-7-15-8-5-9-16(13-15)17-10-6-12-18(14-17)11-4-2/h3,5,8-9,13,17H,1,4,6-7,10-12,14H2,2H3/t17-/m1/s1 |
| InChIKey | YCOYVHRSUJTZLM-QGZVFWFLSA-N |
| Molecular Weight | 243.394 g/mol |
| SMILES | C1N(CCC[C@]1(C=1C=C(C=CC1)CC=C)[H])CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.861989 |