SpectraBase Spectrum ID |
1wY9w03Flub |
Name |
Benzamide, N-(1,1-dimethylethyl)-4-methyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
191.131014170 u |
Formula |
C12H17NO |
InChI |
InChI=1S/C12H17NO/c1-9-5-7-10(8-6-9)11(14)13-12(2,3)4/h5-8H,1-4H3,(H,13,14) |
InChIKey |
BHVOUXZTZXPBQA-UHFFFAOYSA-N |
Molecular Weight |
191.274 g/mol |
SMILES |
C(NC(C)(C)C)(=O)C1=CC=C(C=C1)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.909152 |