SpectraBase Spectrum ID |
3ZfeewLHjl2 |
Name |
bis(4-Methoxycarbonylbenzyl)imine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
311.115758027 u |
Formula |
C18H17NO4 |
InChI |
InChI=1S/C18H17NO4/c1-22-17(20)15-7-3-13(4-8-15)11-19-12-14-5-9-16(10-6-14)18(21)23-2/h3-11H,12H2,1-2H3/b19-11+ |
InChIKey |
SIIANAGTCHTNCR-YBFXNURJSA-N |
Molecular Weight |
311.337 g/mol |
SMILES |
C(C=1C=CC(\C=N\CC=2C=CC(C(=O)OC)=CC2)=CC1)(=O)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.943984 |