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1-acetonyl-2-methyl-1,3-cyclopentanedione
SpectraBase Compound ID EPsqnvN61BA
InChI InChI=1S/C9H12O3/c1-6(10)5-9(2)7(11)3-4-8(9)12/h3-5H2,1-2H3
InChIKey NLOWZUTUCRHACT-UHFFFAOYSA-N
Mol Weight 168.19 g/mol
Molecular Formula C9H12O3
Exact Mass 168.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5pLOTdqxw4e
Name 1,3-Cyclopentanedione, 2-methyl-2-(2-oxopropyl)-
CAS Registry Number 73739-84-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O3
InChI InChI=1S/C9H12O3/c1-6(10)5-9(2)7(11)3-4-8(9)12/h3-5H2,1-2H3
InChIKey NLOWZUTUCRHACT-UHFFFAOYSA-N
Molecular Weight 168.192 g/mol
SMILES C1(C(CCC1=O)=O)(CC(=O)C)C
SPLASH splash10-004i-2900000000-3225c66f972add6bc6fd
Source of Spectrum J-54-3389-6
Synonyms 2-Acetonyl-2-methyl-cyclopentane-1,3-dione 2-Acetonyl-2-methyl-cyclopentane-1,3-quinone 2-Methyl-2-(2-oxidanylidenepropyl)cyclopentane-1,3-dione 2-Methyl-2-(2-oxopropyl)cyclopentane-1,3-dione
Wiley ID 1164380