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Propanedioic acid, (2,4-dimethyl-2,4-pentadienyl)-, dimethyl ester
SpectraBase Compound ID 9cjm4af3CBL
InChI InChI=1S/C12H18O4/c1-8(2)6-9(3)7-10(11(13)15-4)12(14)16-5/h6,10H,1,7H2,2-5H3/b9-6+
InChIKey QTFOBASECMLSEM-RMKNXTFCSA-N
Mol Weight 226.27 g/mol
Molecular Formula C12H18O4
Exact Mass 226.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eg0VfzQ1XeG
Name Propanedioic acid, (2,4-dimethyl-2,4-pentadienyl)-, dimethyl ester
CAS Registry Number 104307-82-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-8(2)6-9(3)7-10(11(13)15-4)12(14)16-5/h6,10H,1,7H2,2-5H3/b9-6+
InChIKey QTFOBASECMLSEM-RMKNXTFCSA-N
Molecular Weight 226.272 g/mol
SMILES C(C(=O)OC)(C(=O)OC)C\C(=C\C(=C)C)C
SPLASH splash10-0002-9700000000-a8b8617f9fe4df5081f4
Source of Spectrum F-41-5770-19
Synonyms Dimethyl 2-[(2E)-2,4-dimethyl-2,4-pentadienyl]malonate Dimethyl(2,4-dimethyl-2,4-pentadienyl)malonate
Wiley ID 1227280