SpectraBase Spectrum ID |
B9CqReJvE |
Name |
N-Methyl-N-(1,4-dioxan-2-ylmethyl)-N-phenylamine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
207.125928789 u |
Formula |
C12H17NO2 |
InChI |
InChI=1S/C12H17NO2/c1-13(11-5-3-2-4-6-11)9-12-10-14-7-8-15-12/h2-6,12H,7-10H2,1H3 |
InChIKey |
DUHTUKSYWLYVQR-UHFFFAOYSA-N |
Molecular Weight |
207.273 g/mol |
SMILES |
C=1(N(CC2OCCOC2)C)C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.944523 |