SpectraBase Spectrum ID |
6R1QtbSUY5e |
Name |
Phthalimide, N-(3-formylpropyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
217.073893215 u |
Formula |
C12H11NO3 |
InChI |
InChI=1S/C12H11NO3/c14-8-4-3-7-13-11(15)9-5-1-2-6-10(9)12(13)16/h1-2,5-6,8H,3-4,7H2 |
InChIKey |
WMXADABRNBNSJC-UHFFFAOYSA-N |
Molecular Weight |
217.224 g/mol |
SMILES |
C1(=O)N(CCCC=O)C(C=2C1=CC=CC2)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.941489 |