SpectraBase Spectrum ID |
ENL1nlwOAQs |
Name |
1-[[1-Phenylcyclopentyl]methyl]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/c1-3-9-16(10-4-1)17(11-5-6-12-17)15-18-13-7-2-8-14-18/h1,3-4,9-10H,2,5-8,11-15H2 |
InChIKey |
ILTQDIOPYLOHDA-UHFFFAOYSA-N |
Molecular Weight |
243.394 g/mol |
SMILES |
C1CCCC1(C1=CC=CC=C1)CN1CCCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.94787 |