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2,2-Dimethyl-3-hexanone
SpectraBase Compound ID 4eFZKFQS05s
InChI InChI=1S/C8H16O/c1-5-6-7(9)8(2,3)4/h5-6H2,1-4H3
InChIKey PYCHXHVFOZBVEY-UHFFFAOYSA-N
Mol Weight 128.21 g/mol
Molecular Formula C8H16O
Exact Mass 128.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EiMkfRxQqtj
Name 3-Hexanone, 2,2-dimethyl-
CAS Registry Number 5405-79-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H16O
InChI InChI=1S/C8H16O/c1-5-6-7(9)8(2,3)4/h5-6H2,1-4H3
InChIKey PYCHXHVFOZBVEY-UHFFFAOYSA-N
Molecular Weight 128.215 g/mol
SMILES CC(C(=O)CCC)(C)C
SPLASH splash10-0abc-9000000000-799cd3b05f796e5cc959
Source of Spectrum NP-16-8147-0
Synonyms 2,2-Dimethyl-3-hexanone 2,2-Dimethylhexan-3-one tert-Butyl Propyl ketone
Wiley ID 1096675