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(E)-3-butene-1,1,4-tricarboxylic acid triethyl ester
SpectraBase Compound ID DVfJRvgyN1M
InChI InChI=1S/C13H20O6/c1-4-17-11(14)9-7-8-10(12(15)18-5-2)13(16)19-6-3/h7,9-10H,4-6,8H2,1-3H3/b9-7+
InChIKey QQLGPQOTLGHRKC-VQHVLOKHSA-N
Mol Weight 272.3 g/mol
Molecular Formula C13H20O6
Exact Mass 272.125988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1V2QKtz5YW1
Name (E)-3-butene-1,1,4-tricarboxylic acid triethyl ester
CAS Registry Number 63082-50-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O6
InChI InChI=1S/C13H20O6/c1-4-17-11(14)9-7-8-10(12(15)18-5-2)13(16)19-6-3/h7,9-10H,4-6,8H2,1-3H3/b9-7+
InChIKey QQLGPQOTLGHRKC-VQHVLOKHSA-N
Molecular Weight 272.297 g/mol
SMILES C(C(=O)OCC)(C(=O)OCC)C\C=C\C(=O)OCC
SPLASH splash10-00b9-6900000000-9950e31cc5f4bc75d6d3
Source of Spectrum B-30-560-0
Synonyms (E)-but-3-ene-1,1,4-tricarboxylic acid triethyl ester Triethyl (3E)-3-butene-1,1,4-tricarboxylate Triethyl (E)-but-3-ene-1,1,4-tricarboxylate
Wiley ID 1275873