SpectraBase Compound ID | 4O6aobPj8DA |
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InChI | InChI=1S/C10H9NO/c1-7-2-4-9-8(6-7)3-5-10(12)11-9/h2-6H,1H3,(H,11,12) |
InChIKey | LOUXUHOSYWFSHV-UHFFFAOYSA-N |
Mol Weight | 159.19 g/mol |
Molecular Formula | C10H9NO |
Exact Mass | 159.068414 g/mol |
SpectraBase Spectrum ID | J1zgIazav0D |
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Name | 6-Methyl-2-quinolone |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 159.068413913 u |
Formula | C10H9NO |
InChI | InChI=1S/C10H9NO/c1-7-2-4-9-8(6-7)3-5-10(12)11-9/h2-6H,1H3,(H,11,12) |
InChIKey | LOUXUHOSYWFSHV-UHFFFAOYSA-N |
Molecular Weight | 159.188 g/mol |
SMILES | C1(NC2=CC=C(C=C2C=C1)C)=O |
Spectrum/Structure Validation Score (Raman) | 0.964734 |