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Propanedioic acid, 2-(3-chloro-1,4-dihydro-1,4-dioxo-2-naphthalenyl)-2-methyl-, diethyl ester
SpectraBase Compound ID 4LBr0RgrNMj
InChI InChI=1S/C18H17ClO6/c1-4-24-16(22)18(3,17(23)25-5-2)12-13(19)15(21)11-9-7-6-8-10(11)14(12)20/h6-9H,4-5H2,1-3H3
InChIKey YARBNBCNDZRZBY-UHFFFAOYSA-N
Mol Weight 364.78 g/mol
Molecular Formula C18H17ClO6
Exact Mass 364.071366 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CunOPDQUep2
Name Propanedioic acid, 2-(3-chloro-1,4-dihydro-1,4-dioxo-2-naphthalenyl)-2-methyl-, diethyl ester
Alternate Name(s) Diethyl 2-(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-2-methylmalonate Diethyl (3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)(methyl)propanedioate 2-(3-Chloro-1,4-dioxo-2-naphthalenyl)-2-methylpropanedioic acid diethyl ester Diethyl 2-(3-chloro-1,4-dioxonaphthalen-2-yl)-2-methylpropanedioate Diethyl 2-(3-chloro-1,4-dioxo-2-naphthyl)-2-methyl-propanedioate Diethyl 2-[3-chloranyl-1,4-bis(oxidanylidene)naphthalen-2-yl]-2-methyl-propanedioate
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Formula C18H17ClO6
InChI InChI=1S/C18H17ClO6/c1-4-24-16(22)18(3,17(23)25-5-2)12-13(19)15(21)11-9-7-6-8-10(11)14(12)20/h6-9H,4-5H2,1-3H3
InChIKey YARBNBCNDZRZBY-UHFFFAOYSA-N
Molecular Weight 364.781 g/mol
SMILES C(C(=O)OCC)(C1=C(Cl)C(=O)c2ccccc2C1=O)(C(OCC)=O)C
SPLASH splash10-004j-6693000000-876f25d6b620358a8906
Source of Spectrum JX-2015-3-1400
Wiley ID 1724890