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2',6'-Di(2-chlorocinnamoyloxy)acetophenone
SpectraBase Compound ID EqL42ia1NSO
InChI InChI=1S/C26H18Cl2O5/c1-17(29)26-22(32-24(30)15-13-18-7-2-4-9-20(18)27)11-6-12-23(26)33-25(31)16-14-19-8-3-5-10-21(19)28/h2-16H,1H3/b15-13+,16-14+
InChIKey HHNYBESXHNFJOP-WXUKJITCSA-N
Mol Weight 481.33 g/mol
Molecular Formula C26H18Cl2O5
Exact Mass 480.053129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7LM1IsmJCO6
Name 2',6'-Di(2-chlorocinnamoyloxy)acetophenone
Alternate Name(s) 2-Acetyl-3-{[(2E)-3-(2-chlorophenyl)-2-propenoyl]oxy}phenyl (2E)-3-(2-chlorophenyl)-2-propenoate
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Formula C26H18Cl2O5
InChI InChI=1S/C26H18Cl2O5/c1-17(29)26-22(32-24(30)15-13-18-7-2-4-9-20(18)27)11-6-12-23(26)33-25(31)16-14-19-8-3-5-10-21(19)28/h2-16H,1H3/b15-13+,16-14+
InChIKey HHNYBESXHNFJOP-WXUKJITCSA-N
Molecular Weight 481.331 g/mol
SMILES c1(c(OC(\C=C\c2c(Cl)cccc2)=O)cccc1OC(\C=C\c1c(Cl)cccc1)=O)C(=O)C
SPLASH splash10-0udi-0900000000-03d5bc0550cec3e2c409
Source of Spectrum C3-24-90-3
Wiley ID 879801