SpectraBase Compound ID | IIGOl6rJEjI |
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InChI | InChI=1S/C13H18O/c1-11(14)9-10-13(2,3)12-7-5-4-6-8-12/h4-8H,9-10H2,1-3H3 |
InChIKey | IFKGKEYWZPTXEY-UHFFFAOYSA-N |
Mol Weight | 190.29 g/mol |
Molecular Formula | C13H18O |
Exact Mass | 190.135765 g/mol |
SpectraBase Spectrum ID | 58MRksnAqdO |
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Name | 2-Hexanone, 5-methyl-5-phenyl- |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 190.135765199 u |
Formula | C13H18O |
InChI | InChI=1S/C13H18O/c1-11(14)9-10-13(2,3)12-7-5-4-6-8-12/h4-8H,9-10H2,1-3H3 |
InChIKey | IFKGKEYWZPTXEY-UHFFFAOYSA-N |
Molecular Weight | 190.286 g/mol |
SMILES | C(C(C)(C)C1=CC=CC=C1)CC(C)=O |