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(E)-3-[7-methoxy-1,4-bis(trifluoromethyl)-8-benzofuro[2,3-d]pyridazinyl]-2-propenoic acid ethyl ester
SpectraBase Compound ID 8w6fABesYV8
InChI InChI=1S/C18H12F6N2O4/c1-3-29-12(27)5-4-8-6-9-11(7-10(8)28-2)30-14-13(9)15(17(19,20)21)25-26-16(14)18(22,23)24/h4-7H,3H2,1-2H3/b5-4+
InChIKey JKMHJYSQJZDZEJ-SNAWJCMRSA-N
Mol Weight 434.29 g/mol
Molecular Formula C18H12F6N2O4
Exact Mass 434.070126 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8DdZcM5zv0X
Name (E)-3-[7-methoxy-1,4-bis(trifluoromethyl)-8-benzofuro[2,3-d]pyridazinyl]-2-propenoic acid ethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C18H12F6N2O4
InChI InChI=1S/C18H12F6N2O4/c1-3-29-12(27)5-4-8-6-9-11(7-10(8)28-2)30-14-13(9)15(17(19,20)21)25-26-16(14)18(22,23)24/h4-7H,3H2,1-2H3/b5-4+
InChIKey JKMHJYSQJZDZEJ-SNAWJCMRSA-N
Molecular Weight 434.294 g/mol
SMILES c12c(c(C(F)(F)F)nnc2C(F)(F)F)oc2c1cc(\C=C\C(=O)OCC)c(OC)c2
SPLASH splash10-000i-0009000000-1e0793d516071223a340
Source of Spectrum SO-0-45-8
Synonyms (E)-3-[7-methoxy-1,4-bis(trifluoromethyl)benzofuro[2,3-d]pyridazin-8-yl]acrylic acid ethyl ester ethyl (E)-3-[7-methoxy-1,4-bis(trifluoromethyl)-[1]benzofuro[2,3-d]pyridazin-8-yl]prop-2-enoate ethyl (E)-3-[7-methoxy-1,4-bis(trifluoromethyl)benzofuro[2,3-d]pyridazin-8-yl]prop-2-enoate
Wiley ID 865285