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(E)-5-hexene-1,1,6-tricarboxylic acid trimethyl ester
SpectraBase Compound ID BgORSAb6LPt
InChI InChI=1S/C12H18O6/c1-16-10(13)8-6-4-5-7-9(11(14)17-2)12(15)18-3/h6,8-9H,4-5,7H2,1-3H3/b8-6+
InChIKey DKVRAQVNUMBNKS-SOFGYWHQSA-N
Mol Weight 258.27 g/mol
Molecular Formula C12H18O6
Exact Mass 258.110338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K8j7EkzeDr5
Name (E)-5-hexene-1,1,6-tricarboxylic acid trimethyl ester
Alternate Name(s) (E)-hex-5-ene-1,1,6-tricarboxylic acid trimethyl ester trans-7-Carbomethoxy-2-octenedioic acid, dimethyl ester Trimethyl (E)-hex-5-ene-1,1,6-tricarboxylate
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Formula C12H18O6
InChI InChI=1S/C12H18O6/c1-16-10(13)8-6-4-5-7-9(11(14)17-2)12(15)18-3/h6,8-9H,4-5,7H2,1-3H3/b8-6+
InChIKey DKVRAQVNUMBNKS-SOFGYWHQSA-N
Molecular Weight 258.270 g/mol
SMILES C(C(=O)OC)(C(=O)OC)CCC\C=C\C(=O)OC
SPLASH splash10-07bk-4900000000-e7d07001c8564f7d5a26
Source of Spectrum O-36-410-0
Wiley ID 848722