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4-methyl-1H-phenanthrene-2,2-dicarboxylic acid diethyl ester
SpectraBase Compound ID DyHcbZOtbc9
InChI InChI=1S/C21H22O4/c1-4-24-19(22)21(20(23)25-5-2)12-14(3)18-16(13-21)11-10-15-8-6-7-9-17(15)18/h6-12H,4-5,13H2,1-3H3
InChIKey YEGPXOMDZNCURK-UHFFFAOYSA-N
Mol Weight 338.4 g/mol
Molecular Formula C21H22O4
Exact Mass 338.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5OC9wHpS9ZN
Name 4-methyl-1H-phenanthrene-2,2-dicarboxylic acid diethyl ester
Alternate Name(s) diethyl 4-methyl-1H-phenanthrene-2,2-dicarboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C21H22O4
InChI InChI=1S/C21H22O4/c1-4-24-19(22)21(20(23)25-5-2)12-14(3)18-16(13-21)11-10-15-8-6-7-9-17(15)18/h6-12H,4-5,13H2,1-3H3
InChIKey YEGPXOMDZNCURK-UHFFFAOYSA-N
Molecular Weight 338.403 g/mol
SMILES C1(C=C(C)c2c(C1)ccc1ccccc21)(C(=O)OCC)C(=O)OCC
SPLASH splash10-0006-0901000000-74b6dd392b8ea44c193e
Source of Spectrum J-65-4917-17
Wiley ID 1532953