SpectraBase Spectrum ID |
6z29pxamkwN |
Name |
p-[(5-Phenoxypentyl)oxy]aniline |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
271.157228918 u |
Formula |
C17H21NO2 |
InChI |
InChI=1S/C17H21NO2/c18-15-9-11-17(12-10-15)20-14-6-2-5-13-19-16-7-3-1-4-8-16/h1,3-4,7-12H,2,5-6,13-14,18H2 |
InChIKey |
XIRZCQLTCRQNDW-UHFFFAOYSA-N |
Molecular Weight |
271.360 g/mol |
SMILES |
NC=1C=CC(OCCCCCOC2=CC=CC=C2)=CC1 |
Spectrum/Structure Validation Score (Raman) |
0.861185 |