SpectraBase Spectrum ID |
A8FazGPlC46 |
Name |
4-Phthalimidopentyl iodide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
343.006923693 u |
Formula |
C13H14INO2 |
InChI |
InChI=1S/C13H14INO2/c1-9(5-4-8-14)15-12(16)10-6-2-3-7-11(10)13(15)17/h2-3,6-7,9H,4-5,8H2,1H3 |
InChIKey |
LFKZPMUQCSOWSZ-UHFFFAOYSA-N |
Molecular Weight |
343.164 g/mol |
SMILES |
C1=CC=CC2=C1C(=O)N(C2=O)C(CCCI)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.950305 |