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3-(3-Methylbutanoyl)-5-(3-methyl-2-butenyl)-1,2,4-cyclopentanetrione
SpectraBase Compound ID 8YTKV7s83Hj
InChI InChI=1S/C15H20O4/c1-8(2)5-6-10-13(17)12(15(19)14(10)18)11(16)7-9(3)4/h5,9-10,12H,6-7H2,1-4H3
InChIKey VPLZOPZMFNZEAQ-UHFFFAOYSA-N
Mol Weight 264.32 g/mol
Molecular Formula C15H20O4
Exact Mass 264.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4up47Ej12z
Name 3-(3-Methylbutanoyl)-5-(3-methyl-2-butenyl)-1,2,4-cyclopentanetrione
CAS Registry Number 3613-60-3
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O4
InChI InChI=1S/C15H20O4/c1-8(2)5-6-10-13(17)12(15(19)14(10)18)11(16)7-9(3)4/h5,9-10,12H,6-7H2,1-4H3
InChIKey VPLZOPZMFNZEAQ-UHFFFAOYSA-N
Molecular Weight 264.321 g/mol
SMILES C1(C(C(=O)C(C1CC=C(C)C)=O)C(=O)CC(C)C)=O
SPLASH splash10-052f-9620000000-f01cbb0a628c76a16f63
Source of Spectrum O-6-983-4
Synonyms 1,2,4-Cyclopentanetrione, 3-isovaleryl-5-(3-methyl-2-butenyl)- 3-(3-Methylbut-2-enyl)-5-(3-methyl-1-oxobutyl)cyclopentane-1,2,4-trione 3-(3-Methylbutanoyl)-5-(3-methylbut-2-enyl)cyclopentane-1,2,4-trione 3-isovaleryl-5-(3-methylbut-2-enyl)cyclopentane-1,2,4-trione
Wiley ID 37958