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2,2,7,7-Tetramethyl-3,6-octanedione
SpectraBase Compound ID DHDYLW986T3
InChI InChI=1S/C12H22O2/c1-11(2,3)9(13)7-8-10(14)12(4,5)6/h7-8H2,1-6H3
InChIKey BCOLMMBVEKNDLK-UHFFFAOYSA-N
Mol Weight 198.31 g/mol
Molecular Formula C12H22O2
Exact Mass 198.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GaCjggT6fmE
Name 2,2,7,7-Tetramethyl-3,6-octanedione
CAS Registry Number 27610-88-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O2
InChI InChI=1S/C12H22O2/c1-11(2,3)9(13)7-8-10(14)12(4,5)6/h7-8H2,1-6H3
InChIKey BCOLMMBVEKNDLK-UHFFFAOYSA-N
Molecular Weight 198.306 g/mol
SMILES CC(C(CCC(C(C)(C)C)=O)=O)(C)C
SPLASH splash10-08fu-4900000000-075f719d2c47b7670f49
Source of Spectrum KC-0-2349-12
Synonyms 2,2,7,7-Tetramethyloctane-3,6-dione
Wiley ID 821820