SpectraBase Spectrum ID |
B7qnyAMMpOO |
Name |
2-Propanamine, N-methyl-1-[4-[3-(1-piperidyl)propoxy]phenyl]- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
290.235813593 u |
Formula |
C18H30N2O |
InChI |
InChI=1S/C18H30N2O/c1-16(19-2)15-17-7-9-18(10-8-17)21-14-6-13-20-11-4-3-5-12-20/h7-10,16,19H,3-6,11-15H2,1-2H3 |
InChIKey |
BAKOXFJIVYIGBQ-UHFFFAOYSA-N |
Molecular Weight |
290.451 g/mol |
SMILES |
C1=C(C=CC(=C1)CC(NC)C)OCCCN1CCCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.955237 |