| SpectraBase Spectrum ID |
34TYn12oVPQ |
| Name |
Isobutyramide, N-(3,4-dimethoxyphenethyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
251.152143537 u |
| Formula |
C14H21NO3 |
| InChI |
InChI=1S/C14H21NO3/c1-10(2)14(16)15-8-7-11-5-6-12(17-3)13(9-11)18-4/h5-6,9-10H,7-8H2,1-4H3,(H,15,16) |
| InChIKey |
INGIQQYCBVCZQD-UHFFFAOYSA-N |
| Molecular Weight |
251.326 g/mol |
| SMILES |
C(C)(C)C(=O)NCCC1=CC=C(OC)C(OC)=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.972865 |
