SpectraBase Spectrum ID |
HVf5byp6K5p |
Name |
N-(4-Methylbenzyl)spiro[3.5]nonan-1-amine |
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/c1-14-5-7-15(8-6-14)13-18-16-9-12-17(16)10-3-2-4-11-17/h5-8,16,18H,2-4,9-13H2,1H3 |
InChIKey |
VKZMIYAJWLVPOA-UHFFFAOYSA-N |
Molecular Weight |
243.394 g/mol |
SMILES |
C1(CCC11CCCCC1)NCC1=CC=C(C=C1)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.902971 |