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Pentanedioic acid, 2-acetyl-4-ethylidene-2-methyl-, diethyl ester, (E)-(.+-.)-
SpectraBase Compound ID GLVhwkiK6Hz
InChI InChI=1S/C14H22O5/c1-6-11(12(16)18-7-2)9-14(5,10(4)15)13(17)19-8-3/h6H,7-9H2,1-5H3/b11-6+
InChIKey DPCYSIVEQQAOPF-IZZDOVSWSA-N
Mol Weight 270.32 g/mol
Molecular Formula C14H22O5
Exact Mass 270.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EblnHJVHTgU
Name Pentanedioic acid, 2-acetyl-4-ethylidene-2-methyl-, diethyl ester, (E)-(.+-.)-
CAS Registry Number 77147-52-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O5
InChI InChI=1S/C14H22O5/c1-6-11(12(16)18-7-2)9-14(5,10(4)15)13(17)19-8-3/h6H,7-9H2,1-5H3/b11-6+
InChIKey DPCYSIVEQQAOPF-IZZDOVSWSA-N
Molecular Weight 270.325 g/mol
SMILES C(C\C(C(=O)OCC)=C/C)(C(=O)OCC)(C(=O)C)C
SPLASH splash10-0fb9-0920000000-d5b273f6a2b0d9fdf229
Source of Spectrum KC-1982-2082-0
Synonyms Diethyl (4E)-2-acetyl-4-ethylidene-2-methylpentanedioate Diethyl 5-methyl-6-oxohept-2-ene-3,5-dicarboxylate
Wiley ID 1274016