SpectraBase Spectrum ID |
BeBZZ7Vkf8Y |
Name |
N-2-Butyl-2-(3-methoxyphenyl)-2-oxoethanimine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
219.125928789 u |
Formula |
C13H17NO2 |
InChI |
InChI=1S/C13H17NO2/c1-4-10(2)14-9-13(15)11-6-5-7-12(8-11)16-3/h5-10H,4H2,1-3H3/b14-9+ |
InChIKey |
ZNOJMWFBMXVNJV-NTEUORMPSA-N |
Molecular Weight |
219.284 g/mol |
SMILES |
C=1(C(\C=N\C(CC)C)=O)C=C(C=CC1)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.930174 |