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2,2,3-TRIMETHYLCYCLOBUTANONE
SpectraBase Compound ID LSCElV8hBVT
InChI InChI=1S/C7H12O/c1-5-4-6(8)7(5,2)3/h5H,4H2,1-3H3
InChIKey XCNUTNIUANPMKW-UHFFFAOYSA-N
Mol Weight 112.17 g/mol
Molecular Formula C7H12O
Exact Mass 112.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 90rFyxiJirB
Name Cyclobutanone, 2,2,3-trimethyl-
CAS Registry Number 1449-49-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O
InChI InChI=1S/C7H12O/c1-5-4-6(8)7(5,2)3/h5H,4H2,1-3H3
InChIKey XCNUTNIUANPMKW-UHFFFAOYSA-N
Molecular Weight 112.172 g/mol
SMILES C1(C(CC1=O)C)(C)C
SPLASH splash10-0596-9000000000-e46b6e8a0a3ea2ad0bf0
Source of Spectrum O-3-148-3
Synonyms 2,2,3-Trimethyl cyclobutanone 2,2,3-trimethyl-1-cyclobutanone 2,2,3-trimethylcyclobutan-1-one
Wiley ID 1123329