SpectraBase Compound ID | 4WuouEcXEXZ |
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InChI | InChI=1S/C6H13NO/c1-5(2)4-7-6(3)8/h5H,4H2,1-3H3,(H,7,8) |
InChIKey | VDQMVRFHUYAKJL-UHFFFAOYSA-N |
Mol Weight | 115.18 g/mol |
Molecular Formula | C6H13NO |
Exact Mass | 115.099714 g/mol |
SpectraBase Spectrum ID | Ka3F33P9UVo |
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Name | Acetamide, N-(2-methylpropyl)- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 115.099714042 u |
Formula | C6H13NO |
InChI | InChI=1S/C6H13NO/c1-5(2)4-7-6(3)8/h5H,4H2,1-3H3,(H,7,8) |
InChIKey | VDQMVRFHUYAKJL-UHFFFAOYSA-N |
Molecular Weight | 115.176 g/mol |
SMILES | C(NC(C)=O)C(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.977626 |