SpectraBase Spectrum ID |
6kKDunv2LX2 |
Name |
N-[2-(3,4-Dimethoxyphenyl)ethyl]-cis-norborn-5-en-endo-2,3-dicarboxyimide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
327.147058156 u |
Formula |
C19H21NO4 |
InChI |
InChI=1S/C19H21NO4/c1-23-14-6-3-11(9-15(14)24-2)7-8-20-18(21)16-12-4-5-13(10-12)17(16)19(20)22/h3-6,9,12-13,16-17H,7-8,10H2,1-2H3/t12?,13?,16-,17+ |
InChIKey |
XTYVHQPRDBFNFI-QDIASNEPSA-N |
Molecular Weight |
327.380 g/mol |
SMILES |
C1(N(C([C@@]2(C3C=CC([C@]12[H])C3)[H])=O)CCC1=CC(OC)=C(C=C1)OC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.949633 |