Dataset

3-((E)-2-(3-((E)-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)quinoxalin-2-yl)vinyl)quinoxaline-2-carbaldehyde

This dataset contains experimental data from a sample (3-[(E)-2-[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]quinoxalin-2-yl]ethenyl]quinoxaline-2-carbaldehyde, InChI=1S/C39H21F17N6O2/c40-32(41,33(42,43)34(44,45)35(46,47)36(48,49)37(50,51)38(52,53)39(54,55)56)17-18-64-31-29(60-24-11-5-6-12-25(24)62-31)16-15-27-26(57-20-7-1-2-8-21(20)58-27)13-14-28-30(19-63)61-23-10-4-3-9-22(23)59-28/h1-16,19H,17-18H2/b14-13+,16-15+).

Chemical Info

InChI	InChI=1S/C39H21F17N6O2/c40-32(41,33(42,43)34(44,45)35(46,47)36(48,49)37(50,51)38(52,53)39(54,55)56)17-18-64-31-29(60-24-11-5-6-12-25(24)62-31)16-15-27-26(57-20-7-1-2-8-21(20)58-27)13-14-28-30(19-63)61-23-10-4-3-9-22(23)59-28/h1-16,19H,17-18H2/b14-13+,16-15+
SMILES	O=Cc1nc2ccccc2nc1/C=C/c1nc2ccccc2nc1/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	BVIOUVOOSLTMGZ-ZBMVRHCNSA-N
Molecular Formula	C39H21F17N6O2
Exact Mass	928.603 g/mol

Data and Resources

3-((E)-2-(3-((E)-2-(3-((3,3,4,4,5,5,6,6,7,7,8,8...HTML
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Related Resources

This dataset related as HasPart to https://dx.doi.org/10.14272/BVIOUVOOSLTMGZ-ZBMVRHCNSA-N/CHMO0000292
This dataset related as HasPart to https://dx.doi.org/10.14272/BVIOUVOOSLTMGZ-ZBMVRHCNSA-N/CHMO0000596
This dataset related as HasPart to https://dx.doi.org/10.14272/BVIOUVOOSLTMGZ-ZBMVRHCNSA-N/CHMO0000596.1
This dataset related as HasPart to https://dx.doi.org/10.14272/BVIOUVOOSLTMGZ-ZBMVRHCNSA-N/CHMO0000595
This dataset related as HasPart to https://dx.doi.org/10.14272/BVIOUVOOSLTMGZ-ZBMVRHCNSA-N/CHMO0000593
This dataset related as HasPart to https://dx.doi.org/10.14272/BVIOUVOOSLTMGZ-ZBMVRHCNSA-N/CHMO0000597
This dataset related as HasPart to https://dx.doi.org/10.14272/BVIOUVOOSLTMGZ-ZBMVRHCNSA-N/CHMO0000470
This dataset related as HasPart to https://dx.doi.org/10.14272/BVIOUVOOSLTMGZ-ZBMVRHCNSA-N/CHMO0000630
This dataset related as IsPartOf to https://dx.doi.org/10.14272/reaction/SA-FUHFF-UHFFFADPSC-BVIOUVOOSL-UHFFFADPSC-NUHFF-NSFJP-NUHFF-ZZZ

Metadata Information

Field	Value
DOI
License URL
Source
Version
Author	Klein, Jérôme
Maintainer	chemotion.net
Language	en
MetadataCreated	2022-10-06T14:10:37.958874
MetadataModified	2022-10-06T14:10:37.958879
MetadataPublished

Field	Value
Measurement Technique
Measurement Variables