SpectraBase Compound ID | L68e7kpZhMi |
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InChI | InChI=1S/C11H15NO/c1-3-9(2)11(13)12-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,12,13) |
InChIKey | YQRDADVUUPKUBC-UHFFFAOYSA-N |
Mol Weight | 177.25 g/mol |
Molecular Formula | C11H15NO |
Exact Mass | 177.115364 g/mol |
SpectraBase Spectrum ID | FrNWnpGqzzG |
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Name | Butanamide, 2-methyl-N-phenyl- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 177.115364106 u |
Formula | C11H15NO |
InChI | InChI=1S/C11H15NO/c1-3-9(2)11(13)12-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,12,13) |
InChIKey | YQRDADVUUPKUBC-UHFFFAOYSA-N |
Molecular Weight | 177.247 g/mol |
SMILES | CC(CC)C(NC1=CC=CC=C1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.8281 |