SpectraBase Spectrum ID |
4hkIu4mdbQ6 |
Name |
N-(2'-Iodophenyl)-N-methyl-2-methyl-2-butenamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
315.012009074 u |
Formula |
C12H14INO |
InChI |
InChI=1S/C12H14INO/c1-4-9(2)12(15)14(3)11-8-6-5-7-10(11)13/h4-8H,1-3H3/b9-4- |
InChIKey |
CGJITGSIAITIPI-WTKPLQERSA-N |
Molecular Weight |
315.154 g/mol |
SMILES |
C(N(C=1C(I)=CC=CC1)C)(\C(=C/C)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.858897 |