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2-(1,4-Dioxo-1,4-dihydronaphthalene-2-ylmethyl)-3,5-di-oxohexanoic acid methyl ester
SpectraBase Compound ID 6rcmNQ7NxbJ
InChI InChI=1S/C18H16O6/c1-10(19)7-15(20)14(18(23)24-2)8-11-9-16(21)12-5-3-4-6-13(12)17(11)22/h3-6,9,14H,7-8H2,1-2H3
InChIKey CTBFTKHWZBCYNP-UHFFFAOYSA-N
Mol Weight 328.32 g/mol
Molecular Formula C18H16O6
Exact Mass 328.094688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6GlfdFYrS4n
Name 2-(1,4-Dioxo-1,4-dihydronaphthalene-2-ylmethyl)-3,5-di-oxohexanoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16O6
InChI InChI=1S/C18H16O6/c1-10(19)7-15(20)14(18(23)24-2)8-11-9-16(21)12-5-3-4-6-13(12)17(11)22/h3-6,9,14H,7-8H2,1-2H3
InChIKey CTBFTKHWZBCYNP-UHFFFAOYSA-N
Literature Reference DOI 10.1002/prac.19963380168
Molecular Weight 328.320 g/mol
SMILES C(C(C(CC(C)=O)=O)CC=1C(c2ccccc2C(C1)=O)=O)(=O)OC
SPLASH splash10-01p9-3291000000-e3c547a38e6578652b49
Source of Spectrum JF-338-353-19
Synonyms Methyl 2-((1,4-dioxo-1,4-dihydronaphthalen-2-yl)methyl)-3,5-dioxohexanoate
Wiley ID 1790019