SpectraBase Spectrum ID |
FZlg9ZNLtKX |
Name |
Benzenemethanol, .alpha.-[4-(methylamino)pentyl]- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
207.162314299 u |
Formula |
C13H21NO |
InChI |
InChI=1S/C13H21NO/c1-11(14-2)7-6-10-13(15)12-8-4-3-5-9-12/h3-5,8-9,11,13-15H,6-7,10H2,1-2H3 |
InChIKey |
KEHGLEBWMGWPDC-UHFFFAOYSA-N |
Molecular Weight |
207.317 g/mol |
SMILES |
C=1(C(O)CCCC(NC)C)C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.968974 |