SpectraBase Compound ID | L4eB3FHRo7C |
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InChI | InChI=1S/C11H15NO/c1-3-12-8-11(13)10-6-4-9(2)5-7-10/h4-7,12H,3,8H2,1-2H3 |
InChIKey | PXUYQJOMLVESQT-UHFFFAOYSA-N |
Mol Weight | 177.25 g/mol |
Molecular Formula | C11H15NO |
Exact Mass | 177.115364 g/mol |
SpectraBase Spectrum ID | 7A2ETBu4H9U |
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Name | 2-Ethylamino-4'-methylacetophenone |
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/c1-3-12-8-11(13)10-6-4-9(2)5-7-10/h4-7,12H,3,8H2,1-2H3 |
InChIKey | PXUYQJOMLVESQT-UHFFFAOYSA-N |
Molecular Weight | 177.247 g/mol |
SMILES | C1(C(CNCC)=O)=CC=C(C=C1)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.907846 |