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2-(4-Methoxycarbonyl-benzoyl)-but-2-enedioic acid diethyl ester
SpectraBase Compound ID 9sA5YnnqkZv
InChI InChI=1S/C17H18O7/c1-4-23-14(18)10-13(17(21)24-5-2)15(19)11-6-8-12(9-7-11)16(20)22-3/h6-10H,4-5H2,1-3H3/b13-10+
InChIKey IHVGSVATJLLROB-JLHYYAGUSA-N
Mol Weight 334.32 g/mol
Molecular Formula C17H18O7
Exact Mass 334.105253 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DsQQfzv18Cf
Name 2-(4-Methoxycarbonyl-benzoyl)-but-2-enedioic acid diethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C17H18O7
InChI InChI=1S/C17H18O7/c1-4-23-14(18)10-13(17(21)24-5-2)15(19)11-6-8-12(9-7-11)16(20)22-3/h6-10H,4-5H2,1-3H3/b13-10+
InChIKey IHVGSVATJLLROB-JLHYYAGUSA-N
Molecular Weight 334.324 g/mol
SMILES C(\C(=C/C(=O)OCC)C(=O)OCC)(c1ccc(C(=O)OC)cc1)=O
SPLASH splash10-001i-0009000000-be899a2760fcf9025a09
Source of Spectrum F-67-5787-1f
Wiley ID 1687249