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5-Phenylbenzene-1,3-dicarboxylic acid diethyl ester
SpectraBase Compound ID 3b9Cgy0tBLX
InChI InChI=1S/C18H18O4/c1-3-21-17(19)15-10-14(13-8-6-5-7-9-13)11-16(12-15)18(20)22-4-2/h5-12H,3-4H2,1-2H3
InChIKey YELBJXFSPZMNBQ-UHFFFAOYSA-N
Mol Weight 298.34 g/mol
Molecular Formula C18H18O4
Exact Mass 298.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8jdKCfaiJlj
Name 5-Phenylbenzene-1,3-dicarboxylic acid diethyl ester
Alternate Name(s) Diethyl 5-phenylbenzene-1,3-dicarboxylate
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Formula C18H18O4
InChI InChI=1S/C18H18O4/c1-3-21-17(19)15-10-14(13-8-6-5-7-9-13)11-16(12-15)18(20)22-4-2/h5-12H,3-4H2,1-2H3
InChIKey YELBJXFSPZMNBQ-UHFFFAOYSA-N
Molecular Weight 298.338 g/mol
SMILES c1(C(=O)OCC)cc(C(=O)OCC)cc(c1)-c1ccccc1
SPLASH splash10-0f6t-0690000000-d983e764efb00dc35d39
Source of Spectrum F-55-12235-21
Wiley ID 839491