Dataset

(E)-3-(2-(3-((3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)oxy)quinoxalin-2-yl)vinyl)quinoxaline-2-carbaldehyde

This dataset contains experimental data from a sample (3-[(E)-2-[3-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecoxy)quinoxalin-2-yl]ethenyl]quinoxaline-2-carbaldehyde, InChI=1S/C29H15F17N4O2/c30-22(31,23(32,33)24(34,35)25(36,37)26(38,39)27(40,41)28(42,43)29(44,45)46)11-12-52-21-19(48-16-7-3-4-8-17(16)50-21)10-9-18-20(13-51)49-15-6-2-1-5-14(15)47-18/h1-10,13H,11-12H2/b10-9+).

Chemical Info

molecular Image
InChI InChI=1S/C29H15F17N4O2/c30-22(31,23(32,33)24(34,35)25(36,37)26(38,39)27(40,41)28(42,43)29(44,45)46)11-12-52-21-19(48-16-7-3-4-8-17(16)50-21)10-9-18-20(13-51)49-15-6-2-1-5-14(15)47-18/h1-10,13H,11-12H2/b10-9+
SMILES O=Cc1nc2ccccc2nc1/C=C/c1nc2ccccc2nc1OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChI Key RXWYWMJYBWVIPF-MDZDMXLPSA-N
Molecular Formula C29H15F17N4O2
Exact Mass 774.431 g/mol

Data and Resources

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Metadata Information

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Author Klein, Jérôme
Maintainer chemotion.net
Language en
MetadataCreated 2022-10-06T14:10:21.508399
MetadataModified 2022-10-06T14:10:21.508403
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