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2-Heptanone, 6-methyl-6-(5-methyl-2-furanyl)-
SpectraBase Compound ID 7gywv6Rzm7O
InChI InChI=1S/C13H20O2/c1-10(14)6-5-9-13(3,4)12-8-7-11(2)15-12/h7-8H,5-6,9H2,1-4H3
InChIKey CQPPRTJQWXGAGK-UHFFFAOYSA-N
Mol Weight 208.3 g/mol
Molecular Formula C13H20O2
Exact Mass 208.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5mL2yFxiqlD
Name 2-Heptanone, 6-methyl-6-(5-methyl-2-furanyl)-
CAS Registry Number 50464-95-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O2
InChI InChI=1S/C13H20O2/c1-10(14)6-5-9-13(3,4)12-8-7-11(2)15-12/h7-8H,5-6,9H2,1-4H3
InChIKey CQPPRTJQWXGAGK-UHFFFAOYSA-N
Molecular Weight 208.301 g/mol
SMILES CC(c1ccc(o1)C)(C)CCCC(=O)C
SPLASH splash10-00di-4900000000-8b27e39dd3f03ac7e47e
Synonyms 6-Methyl-6-(5-methyl-2-furyl)heptan-2-one 6-Methyl-6-(5-methyl-2-furanyl)-2-heptanone 6-Methyl-6-(5-methyl-2-furyl)-2-heptanone 6-Methyl-6-(5-methylfuran-2-yl)heptan-2-one
Wiley ID 1480318