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(S)-(-)-5,6-Dimethylheptan-2-one
SpectraBase Compound ID Fh8kQbhfJtT
InChI InChI=1S/C9H18O/c1-7(2)8(3)5-6-9(4)10/h7-8H,5-6H2,1-4H3/t8-/m0/s1
InChIKey WQCPCHUHFFYMFU-QMMMGPOBSA-N
Mol Weight 142.24 g/mol
Molecular Formula C9H18O
Exact Mass 142.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L73PcGw0cXF
Name (S)-(-)-5,6-Dimethylheptan-2-one
Classification Ketones
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 142.135765199 u
Formula C9H18O
InChI InChI=1S/C9H18O/c1-7(2)8(3)5-6-9(4)10/h7-8H,5-6H2,1-4H3/t8-/m0/s1
InChIKey WQCPCHUHFFYMFU-QMMMGPOBSA-N
Molecular Weight 142.242 g/mol
Number of Peaks 14
SMILES C(C[C@@](C(C)C)(C)[H])C(C)=O
SPLASH splash10-0006-9000000000-8b9ecdbc6a724a40e948
Source of Spectrum FF-16-207-3 (DOI: 10.1002/ffj.980)
Synonyms (S)-5,6-dimethylheptan-2-one (5S)-5,6-dimethyl-2-heptanone
Wiley ID 1775288