SpectraBase Spectrum ID |
8Xi2Xw2Pbev |
Name |
4,4'-(Tetramethylenedioxy)dianiline |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
272.152477890 u |
Formula |
C16H20N2O2 |
InChI |
InChI=1S/C16H20N2O2/c17-13-3-7-15(8-4-13)19-11-1-2-12-20-16-9-5-14(18)6-10-16/h3-10H,1-2,11-12,17-18H2 |
InChIKey |
LAFZPVANKKJENB-UHFFFAOYSA-N |
Molecular Weight |
272.348 g/mol |
SMILES |
NC1=CC=C(OCCCCOC=2C=CC(=CC2)N)C=C1 |
Spectrum/Structure Validation Score (Raman) |
0.814723 |