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2-(3'-Methyl)butanoyl-4-(3'-methyl)butyltetronic acid
SpectraBase Compound ID DTgRn3mxiR2
InChI InChI=1S/C14H22O4/c1-8(2)5-6-10-12(16)13(18-14(10)17)11(15)7-9(3)4/h8-10,13H,5-7H2,1-4H3
InChIKey FITZBKHIYBBILH-UHFFFAOYSA-N
Mol Weight 254.33 g/mol
Molecular Formula C14H22O4
Exact Mass 254.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 28Xx7wbis26
Name 2-(3'-Methyl)butanoyl-4-(3'-methyl)butyltetronic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O4
InChI InChI=1S/C14H22O4/c1-8(2)5-6-10-12(16)13(18-14(10)17)11(15)7-9(3)4/h8-10,13H,5-7H2,1-4H3
InChIKey FITZBKHIYBBILH-UHFFFAOYSA-N
Molecular Weight 254.326 g/mol
SMILES C1(OC(=O)C(C1=O)CCC(C)C)C(CC(C)C)=O
SPLASH splash10-0006-9000000000-3153aecc6b0bc043386c
Source of Spectrum F-32-2925-0
Synonyms 2-(3'-Methyl)butanoyl-4-(3'-methyl)butyltetetronic acid 3-isopentyl-5-(3-methylbutanoyl)-2,4(3H,5H)-furandione
Wiley ID 1257647