SpectraBase Spectrum ID |
7dxIjeMa8ac |
Name |
2-Methylene-3-[methyl-(phenylmethyl)amino]butanedioic acid dimethyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
277.131408092 u |
Formula |
C15H19NO4 |
InChI |
InChI=1S/C15H19NO4/c1-11(14(17)19-3)13(15(18)20-4)16(2)10-12-8-6-5-7-9-12/h5-9,13H,1,10H2,2-4H3 |
InChIKey |
UYBYAIRZQHFARF-UHFFFAOYSA-N |
SMILES |
C(C(N(CC=1C=CC=CC1)C)C(=O)OC)(C(=O)OC)=C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.982084 |