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2-(4-(2-chlorophenyl)buta-2,3-dienyl)malonate
SpectraBase Compound ID 4UcqkudoPkt
InChI InChI=1S/C15H15ClO4/c1-19-14(17)12(15(18)20-2)9-5-3-7-11-8-4-6-10-13(11)16/h4-8,10,12H,9H2,1-2H3
InChIKey XKKBUFIPQFYSNA-UHFFFAOYSA-N
Mol Weight 294.73 g/mol
Molecular Formula C15H15ClO4
Exact Mass 294.065887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FKmqEHAeyL7
Name (+/-)-dimethyl 2-(4-(2-chlorophenyl)buta-2,3-dienyl)malonate
Appearance Liquid
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Formula C15H15ClO4
InChI InChI=1S/C15H15ClO4/c1-19-14(17)12(15(18)20-2)9-5-3-7-11-8-4-6-10-13(11)16/h4-8,10,12H,9H2,1-2H3
InChIKey XKKBUFIPQFYSNA-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/cjoc.202000300
Molecular Weight 294.734 g/mol
Reported Formula C15H15(35)ClO4
SMILES C(C(C(=O)OC)CC=C=Cc1c(cccc1)Cl)(=O)OC
SPLASH splash10-03di-0900000000-5dac890ea2a01aa3a00e
Source of Spectrum CJC-38-SM22-(+/-)-3la
Wiley ID 1856150