SpectraBase Spectrum ID |
EtYeRL9Sg95 |
Name |
2,2'-(Pentamethylenedioxy)dianiline |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
286.168127954 u |
Formula |
C17H22N2O2 |
InChI |
InChI=1S/C17H22N2O2/c18-14-8-2-4-10-16(14)20-12-6-1-7-13-21-17-11-5-3-9-15(17)19/h2-5,8-11H,1,6-7,12-13,18-19H2 |
InChIKey |
HSXOPVQWOCZEEG-UHFFFAOYSA-N |
Molecular Weight |
286.375 g/mol |
SMILES |
NC=1C=CC=CC1OCCCCCOC=1C(=CC=CC1)N |
Spectrum/Structure Validation Score (Raman) |
0.956481 |