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4-Hydroxy-5-(3-methylbutanoyl)-2,2-bis(3-methyl-2-butenyl)-4-cyclopentene-1,3-dione
SpectraBase Compound ID 509XfmQcGbK
InChI InChI=1S/C20H28O4/c1-12(2)7-9-20(10-8-13(3)4)18(23)16(17(22)19(20)24)15(21)11-14(5)6/h7-8,14,22H,9-11H2,1-6H3
InChIKey YDAFVJGIRJZGKB-UHFFFAOYSA-N
Mol Weight 332.44 g/mol
Molecular Formula C20H28O4
Exact Mass 332.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3xphb4zLe4
Name 4-Hydroxy-5-(3-methylbutanoyl)-2,2-bis(3-methyl-2-butenyl)-4-cyclopentene-1,3-dione
Alternate Name(s) 1,3-Cyclopentanedione, 4-hydroxy-2,2-bis(3-methyl-2-butenyl)-5-(3-methyl-1-oxobutyl)- Cyclopent-4-ene-1,3-dione, 4-Hydroxy-2,2-bis(3-methyl-2-butenyl)-5-(3-methyl-1-oxobutyl)- 4-(3-Methylbutanoyl)-2,2-bis(3-methylbut-2-enyl)-5-oxidanyl-cyclopent-4-ene-1,3-dione 4-Hydroxy-2,2-bis(3-methyl-2-butenyl)-5-(3-methyl-1-oxobutyl)-cyclopent-4-en-1,3-dione 4-Hydroxy-2,2-bis(3-methylbut-2-enyl)-5-(3-methyl-1-oxobutyl)cyclopent-4-ene-1,3-dione 4-Hydroxy-5-(3-methylbutanoyl)-2,2-bis(3-methylbut-2-enyl)cyclopent-4-ene-1,3-dione 4-Hydroxy-5-isovaleryl-2,2-bis(3-methylbut-2-enyl)cyclopent-4-ene-1,3-quinone
CAS Registry Number 38574-31-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O4
InChI InChI=1S/C20H28O4/c1-12(2)7-9-20(10-8-13(3)4)18(23)16(17(22)19(20)24)15(21)11-14(5)6/h7-8,14,22H,9-11H2,1-6H3
InChIKey YDAFVJGIRJZGKB-UHFFFAOYSA-N
Molecular Weight 332.440 g/mol
SMILES OC1=C(C(C(C1=O)(CC=C(C)C)CC=C(C)C)=O)C(CC(C)C)=O
SPLASH splash10-03yi-5693000000-5248f2e0e5b2f6164324
Source of Spectrum W6-1989-15461-0
Wiley ID 140853