SpectraBase Compound ID | 2NhADHkGcYu |
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InChI | InChI=1S/C12H15NO/c1-4-9-13(3)12(14)11-8-6-5-7-10(11)2/h4-8H,1,9H2,2-3H3 |
InChIKey | UIGLDUMQVLDGFS-UHFFFAOYSA-N |
Mol Weight | 189.26 g/mol |
Molecular Formula | C12H15NO |
Exact Mass | 189.115364 g/mol |
SpectraBase Spectrum ID | HTAPuuYpkO0 |
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Name | Benzamide, 2,N-dimethyl-N-allyl- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 189.115364106 u |
Formula | C12H15NO |
InChI | InChI=1S/C12H15NO/c1-4-9-13(3)12(14)11-8-6-5-7-10(11)2/h4-8H,1,9H2,2-3H3 |
InChIKey | UIGLDUMQVLDGFS-UHFFFAOYSA-N |
Molecular Weight | 189.258 g/mol |
SMILES | C(N(C)CC=C)(=O)C=1C(C)=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.894864 |