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3-Hexanone, 2,4-dimethyl-
SpectraBase Compound ID 5WVqE4ONyRG
InChI InChI=1S/C8H16O/c1-5-7(4)8(9)6(2)3/h6-7H,5H2,1-4H3
InChIKey PZAPVPGZDHJUTO-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 DYM68G4zpQF
Name 3-Hexanone, 2,4-dimethyl-
CAS Registry Number 18641-70-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H16O
InChI InChI=1S/C8H16O/c1-5-7(4)8(9)6(2)3/h6-7H,5H2,1-4H3
InChIKey PZAPVPGZDHJUTO-UHFFFAOYSA-N
Molecular Weight 128.215 g/mol
SMILES CCC(C)C(=O)C(C)C
SPLASH splash10-054o-9000000000-d20e24bd99689d426677
Source of Spectrum EP-4035-0-0
Synonyms 2,4-Dimethyl-3-hexanone 2,4-Dimethyl hexanone-3 2,4-Dimethylhexan-3-one
Wiley ID 1131626