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2-Methylidenepropane-1,3-diyl-1((E)-2'-methyl-2'-butenoate)-3-isobutyrate
SpectraBase Compound ID GcDixcj6C7X
InChI InChI=1S/C13H20O4/c1-6-11(5)13(15)17-8-10(4)7-16-12(14)9(2)3/h6,9H,4,7-8H2,1-3,5H3/b11-6+
InChIKey VFRXORHDSSTODU-IZZDOVSWSA-N
Mol Weight 240.3 g/mol
Molecular Formula C13H20O4
Exact Mass 240.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 74NzXxlEErW
Name 2-Methylidenepropane-1,3-diyl-1((E)-2'-methyl-2'-butenoate)-3-isobutyrate
CAS Registry Number 80500-80-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O4
InChI InChI=1S/C13H20O4/c1-6-11(5)13(15)17-8-10(4)7-16-12(14)9(2)3/h6,9H,4,7-8H2,1-3,5H3/b11-6+
InChIKey VFRXORHDSSTODU-IZZDOVSWSA-N
Molecular Weight 240.299 g/mol
SMILES C(\C(=C\C)C)(OCC(=C)COC(=O)C(C)C)=O
SPLASH splash10-001l-9000000000-87016eeb38cb780076c4
Source of Spectrum LQ-1992-3914-0
Synonyms 2-Butenoic acid, 2-methyl-, 2-[(2-methyl-1-oxopropoxy)methyl]-2-propenyl ester, (E)- 2-Methylidenepropane-1,3-diyl 1-((E)-2'-methyl-2'-butenoate) 3-isobutyrate 2-[(isobutyryloxy)methyl]-2-propenyl (2E)-2-methyl-2-butenoate
Wiley ID 1242851