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2-Butenedioic acid, 2-(1-ethylidene-2-methyl-2-propenyl)-, dimethyl ester, (Z,?)-
SpectraBase Compound ID Jdd15mD6v4g
InChI InChI=1S/C12H16O4/c1-6-9(8(2)3)10(12(14)16-5)7-11(13)15-4/h6-7H,2H2,1,3-5H3/b9-6-,10-7+
InChIKey LHVGIUKWXAQQAN-PCCLLEMOSA-N
Mol Weight 224.26 g/mol
Molecular Formula C12H16O4
Exact Mass 224.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1IWzRJRFtw
Name 2-Butenedioic acid, 2-(1-ethylidene-2-methyl-2-propenyl)-, dimethyl ester, (Z,?)-
CAS Registry Number 68930-30-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O4
InChI InChI=1S/C12H16O4/c1-6-9(8(2)3)10(12(14)16-5)7-11(13)15-4/h6-7H,2H2,1,3-5H3/b9-6-,10-7+
InChIKey LHVGIUKWXAQQAN-PCCLLEMOSA-N
Molecular Weight 224.256 g/mol
SMILES C(\C(\C(=C/C(=O)OC)C(=O)OC)=C/C)(=C)C
SPLASH splash10-0bu3-0900000000-e7fd83cc273cc06394f9
Source of Spectrum KC-1978-1167-0
Synonyms Dimethyl (2E)-2-[(1Z)-1-isopropenyl-1-propenyl]-2-butenedioate Methyl(Z,?)-3-methoxycarbonyl-4-(prop-2-enyl)hexa-2,4-dienoate
Wiley ID 1224892