SpectraBase Spectrum ID |
EmwL3emQ1LU |
Name |
N-(4-Methoxyphenyl)-N-(1,3-dioxan-2-ylmethyl)amine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
223.120843408 u |
Formula |
C12H17NO3 |
InChI |
InChI=1S/C12H17NO3/c1-14-11-5-3-10(4-6-11)13-9-12-15-7-2-8-16-12/h3-6,12-13H,2,7-9H2,1H3 |
InChIKey |
DOQMHUOEGOKWEL-UHFFFAOYSA-N |
Molecular Weight |
223.272 g/mol |
SMILES |
C(NC=1C=CC(=CC1)OC)C1OCCCO1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.932918 |