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bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid dimethyl ester
SpectraBase Compound ID 1SrPlDkIf5j
InChI InChI=1S/C12H16O4/c1-15-11(13)9-7-3-5-8(6-4-7)10(9)12(14)16-2/h3,5,7-10H,4,6H2,1-2H3/t7-,8+,9-,10-/m1/s1
InChIKey FPRGHVZMTXXTRC-UTINFBMNSA-N
Mol Weight 224.26 g/mol
Molecular Formula C12H16O4
Exact Mass 224.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 77lIfUPysVx
Name bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic acid dimethyl ester
CAS Registry Number 31517-37-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O4
InChI InChI=1S/C12H16O4/c1-15-11(13)9-7-3-5-8(6-4-7)10(9)12(14)16-2/h3,5,7-10H,4,6H2,1-2H3/t7-,8+,9-,10-/m1/s1
InChIKey FPRGHVZMTXXTRC-UTINFBMNSA-N
Molecular Weight 224.256 g/mol
SMILES [C@]1([C@](C(=O)OC)([C@]2(C=C[C@@]1(CC2)[H])[H])[H])(C(=O)OC)[H]
SPLASH splash10-057i-9600000000-238da797e8cc96320e9e
Source of Spectrum H-77-2104-33
Synonyms Dimethyl bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylate
Wiley ID 1225045