SpectraBase Spectrum ID |
86z7vd2MRo7 |
Name |
Methyl 2-[(dimethylamino)methyl]-6-methoxybenzoate |
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/c1-13(2)8-9-6-5-7-10(15-3)11(9)12(14)16-4/h5-7H,8H2,1-4H3 |
InChIKey |
VSFTZOYROFAPBO-UHFFFAOYSA-N |
Molecular Weight |
223.272 g/mol |
SMILES |
C1(=C(CN(C)C)C=CC=C1OC)C(=O)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.846181 |