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4-Hydroxy-3,6-dimethylheptan-2-one
SpectraBase Compound ID LLacaIBw6KN
InChI InChI=1S/C9H18O2/c1-6(2)5-9(11)7(3)8(4)10/h6-7,9,11H,5H2,1-4H3
InChIKey HXLCSPKXTYFBGW-UHFFFAOYSA-N
Mol Weight 158.24 g/mol
Molecular Formula C9H18O2
Exact Mass 158.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EZf6yatvO6r
Name 4-Hydroxy-3,6-dimethylheptan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H18O2
InChI InChI=1S/C9H18O2/c1-6(2)5-9(11)7(3)8(4)10/h6-7,9,11H,5H2,1-4H3
InChIKey HXLCSPKXTYFBGW-UHFFFAOYSA-N
Molecular Weight 158.241 g/mol
SMILES OC(C(C(=O)C)C)CC(C)C
SPLASH splash10-0abc-0900000000-b5c5702943cec4a350e4
Source of Spectrum KC-19880-2858-3
Synonyms 3,6-Dimethyl-4-oxidanyl-heptan-2-one 4-Hydroxy-3,6-dimethyl-2-heptanone
Wiley ID 1155575