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Isovaleryl indandione
SpectraBase Compound ID CCRQ2jDP98a
InChI InChI=1S/C14H14O3/c1-8(2)7-11(15)12-13(16)9-5-3-4-6-10(9)14(12)17/h3-6,8,12H,7H2,1-2H3
InChIKey PVWMAOPFDINGAY-UHFFFAOYSA-N
Mol Weight 230.26 g/mol
Molecular Formula C14H14O3
Exact Mass 230.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6VYIgIUkSNX
Name Isovaleryl indandione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14O3
InChI InChI=1S/C14H14O3/c1-8(2)7-11(15)12-13(16)9-5-3-4-6-10(9)14(12)17/h3-6,8,12H,7H2,1-2H3
InChIKey PVWMAOPFDINGAY-UHFFFAOYSA-N
Molecular Weight 230.263 g/mol
SMILES c12ccccc2C(C(C1=O)C(CC(C)C)=O)=O
SPLASH splash10-00di-3900000000-68b3f997ecbfef433e1a
Source of Spectrum SWG-33-4783-0
Synonyms 2-Isovaleryl-1,3-indanedione 2-Isovalerylindan-1,3-dione; 2-(3-methylbutanoyl)-1H-indene-1,3(2H)-dione 2-(3-Methyl-1-oxobutyl)-1H-indene-1,3(2H)-dione Valone Isoval 2-(3-Methylbutanoyl)-1H-indene-1,3(2H)-dione
Wiley ID 1811376