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3-Cyclohexene-1,1-dicarboxylic acid, 4-methyl-5-methylene-, diethyl ester
SpectraBase Compound ID DxXe5zQ5g1W
InChI InChI=1S/C14H20O4/c1-5-17-12(15)14(13(16)18-6-2)8-7-10(3)11(4)9-14/h7H,4-6,8-9H2,1-3H3
InChIKey QGOMEJVEJAKHOL-UHFFFAOYSA-N
Mol Weight 252.31 g/mol
Molecular Formula C14H20O4
Exact Mass 252.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5EGHXIkfhwj
Name 3-Cyclohexene-1,1-dicarboxylic acid, 4-methyl-5-methylene-, diethyl ester
CAS Registry Number 94922-21-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O4
InChI InChI=1S/C14H20O4/c1-5-17-12(15)14(13(16)18-6-2)8-7-10(3)11(4)9-14/h7H,4-6,8-9H2,1-3H3
InChIKey QGOMEJVEJAKHOL-UHFFFAOYSA-N
Molecular Weight 252.310 g/mol
SMILES C1(CC(=C)C(=CC1)C)(C(=O)OCC)C(=O)OCC
SPLASH splash10-0a6r-0930000000-8ff11ec616896bc6cf94
Source of Spectrum F-44-2046-31
Synonyms Diethyl 5-methylene-4-methylcyclohex-3-ene-1,1-dicarboxylate Diethyl 4-methyl-5-methylene-3-cyclohexene-1,1-dicarboxylate Diethyl 4-methyl-5-methylenecyclohex-3-ene-1,1-dicarboxylate
Wiley ID 1255578