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1,3-Heptadiene-1,2,6,6-tetracarboxylic acid, 5-methyl-, 6,6-diethyl 1,2-dimethyl ester, (Z,E)-
SpectraBase Compound ID 8tC4BR2BfJN
InChI InChI=1S/C18H26O8/c1-7-25-16(21)18(4,17(22)26-8-2)12(3)9-10-13(15(20)24-6)11-14(19)23-5/h9-12H,7-8H2,1-6H3/b10-9+,13-11+
InChIKey QNYWVNQZVSVSRO-SNMPHBPQSA-N
Mol Weight 370.4 g/mol
Molecular Formula C18H26O8
Exact Mass 370.162768 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 11fMkekIajc
Name 1,3-Heptadiene-1,2,6,6-tetracarboxylic acid, 5-methyl-, 6,6-diethyl 1,2-dimethyl ester, (Z,E)-
CAS Registry Number 58838-26-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O8
InChI InChI=1S/C18H26O8/c1-7-25-16(21)18(4,17(22)26-8-2)12(3)9-10-13(15(20)24-6)11-14(19)23-5/h9-12H,7-8H2,1-6H3/b10-9+,13-11+
InChIKey QNYWVNQZVSVSRO-SNMPHBPQSA-N
Molecular Weight 370.398 g/mol
SMILES C(C(=O)OCC)(C(=O)OCC)(C(\C=C\C(=C/C(=O)OC)C(=O)OC)C)C
SPLASH splash10-0002-1900000000-f4301437e39f55c38101
Source of Spectrum C-98-1210-0
Synonyms 6,6-Diethyl 1,2-dimethyl (1E,3E)-5-methyl-1,3-heptadiene-1,2,6,6-tetracarboxylate Methyl 3-carbomethoxy-7,7-dicarboethoxy-6-methyl-2,4-octadienoate
Wiley ID 1354119