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2-((Z)-2-Chloro-1-methyl-3-phenyl-allyl)-malonic acid diethyl ester
SpectraBase Compound ID 62finfMeSrX
InChI InChI=1S/C17H21ClO4/c1-4-21-16(19)15(17(20)22-5-2)12(3)14(18)11-13-9-7-6-8-10-13/h6-12,15H,4-5H2,1-3H3/b14-11-
InChIKey YUCNSXSFHWBVEQ-KAMYIIQDSA-N
Mol Weight 324.8 g/mol
Molecular Formula C17H21ClO4
Exact Mass 324.112837 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CIweXgXgkIX
Name 2-((Z)-2-Chloro-1-methyl-3-phenyl-allyl)-malonic acid diethyl ester
Alternate Name(s) Diethyl 2-[(2Z)-2-chloro-1-methyl-3-phenyl-2-propenyl]malonate Diethyl 2-[3-(1-phenyl-2-chloro)-1-butenyl]malonate 2-[(Z)-3-chloro-4-phenylbut-3-en-2-yl]propanedioic acid diethyl ester Diethyl 2-[(Z)-3-chloro-4-phenylbut-3-en-2-yl]propanedioate Diethyl 2-[(Z)-2-chloro-1-methyl-3-phenyl-allyl]propanedioate Diethyl 2-[(Z)-3-chloranyl-4-phenyl-but-3-en-2-yl]propanedioate
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Formula C17H21ClO4
InChI InChI=1S/C17H21ClO4/c1-4-21-16(19)15(17(20)22-5-2)12(3)14(18)11-13-9-7-6-8-10-13/h6-12,15H,4-5H2,1-3H3/b14-11-
InChIKey YUCNSXSFHWBVEQ-KAMYIIQDSA-N
Molecular Weight 324.804 g/mol
SMILES C(C(\C(=C\c1ccccc1)Cl)C)(C(=O)OCC)C(=O)OCC
SPLASH splash10-004i-0940000000-88a1b78c301096bc5f39
Source of Spectrum J-64-7526-18
Wiley ID 1531191