SpectraBase Spectrum ID |
2kRulnSGkNx |
Name |
Isobutyramide, N-(2,4-dimethoxyphenyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
223.120843408 u |
Formula |
C12H17NO3 |
InChI |
InChI=1S/C12H17NO3/c1-8(2)12(14)13-10-6-5-9(15-3)7-11(10)16-4/h5-8H,1-4H3,(H,13,14) |
InChIKey |
JTYFRQNSPVYNJV-UHFFFAOYSA-N |
Molecular Weight |
223.272 g/mol |
SMILES |
C(C)(C)C(=O)NC1=CC=C(OC)C=C1OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.878638 |