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3-Methyl-2-dodecanone
SpectraBase Compound ID Kbcz8Nli6On
InChI InChI=1S/C13H26O/c1-4-5-6-7-8-9-10-11-12(2)13(3)14/h12H,4-11H2,1-3H3
InChIKey GMHKMNMMACOKTD-UHFFFAOYSA-N
Mol Weight 198.35 g/mol
Molecular Formula C13H26O
Exact Mass 198.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Fj6vTSdwO7
Name 3-Methyl-2-dodecanone
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H26O
InChI InChI=1S/C13H26O/c1-4-5-6-7-8-9-10-11-12(2)13(3)14/h12H,4-11H2,1-3H3
InChIKey GMHKMNMMACOKTD-UHFFFAOYSA-N
Instrument Name Agilent 7890B-5977A
Ionization Type EI
Literature Reference DOI 10.1002/cbic.202000503
Molecular Weight 198.350 g/mol
Reported Formula C13H26O
SMILES C(=O)(C)C(CCCCCCCCC)C
SPLASH splash10-00dl-9000000000-b18b7fe818905728362c
Source of Spectrum CBC-21-3613-86
Thin-Layer Chromatography Rf = 0.35 (cyclohexane/ethyl acetate, 20:1)
Wiley ID 1856003