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Methyl 7-formyl-3-oxo-2-[2'-pentenyl]-6-heptenoate
SpectraBase Compound ID CNlYARwK9hB
InChI InChI=1S/C14H20O4/c1-3-4-6-9-12(14(17)18-2)13(16)10-7-5-8-11-15/h4-6,8,11-12H,3,7,9-10H2,1-2H3/b6-4-,8-5+
InChIKey UFFCENBEGDJWNJ-QXMOYCCXSA-N
Mol Weight 252.31 g/mol
Molecular Formula C14H20O4
Exact Mass 252.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BNv7muf9o8K
Name Methyl 7-formyl-3-oxo-2-[2'-pentenyl]-6-heptenoate
Alternate Name(s) Methyl (6E)-3,8-dioxo-2-[(2Z)-2-pentenyl]-6-octenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O4
InChI InChI=1S/C14H20O4/c1-3-4-6-9-12(14(17)18-2)13(16)10-7-5-8-11-15/h4-6,8,11-12H,3,7,9-10H2,1-2H3/b6-4-,8-5+
InChIKey UFFCENBEGDJWNJ-QXMOYCCXSA-N
Molecular Weight 252.310 g/mol
SMILES C(C(=O)OC)(C(=O)CC\C=C\C=O)C\C=C/CC
SPLASH splash10-0536-3900000000-44a6d4e23e49061c21f8
Source of Spectrum SK-22-1288-7
Wiley ID 852126