Dataset

2-(4-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluorononyl)-1,3-dioxolan-2-yl)-3-((E)-2-(3-((E)-2-(3-methylquinoxalin-2-yl)vinyl)quinoxalin-2-yl)vinyl)quinoxaline

This dataset contains experimental data from a sample (2-[4-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluorononyl)-1,3-dioxolan-2-yl]-3-[(E)-2-[3-[(E)-2-(3-methylquinoxalin-2-yl)ethenyl]quinoxalin-2-yl]ethenyl]quinoxaline, InChI=1S/C41H25F17N6O2/c1-20-22(60-24-9-3-2-8-23(24)59-20)14-15-29-30(62-26-11-5-4-10-25(26)61-29)16-17-31-32(64-28-13-7-6-12-27(28)63-31)33-65-19-21(66-33)18-34(42,43)35(44,45)36(46,47)37(48,49)38(50,51)39(52,53)40(54,55)41(56,57)58/h2-17,21,33H,18-19H2,1H3/b15-14+,17-16+).

Chemical Info

InChI	InChI=1S/C41H25F17N6O2/c1-20-22(60-24-9-3-2-8-23(24)59-20)14-15-29-30(62-26-11-5-4-10-25(26)61-29)16-17-31-32(64-28-13-7-6-12-27(28)63-31)33-65-19-21(66-33)18-34(42,43)35(44,45)36(46,47)37(48,49)38(50,51)39(52,53)40(54,55)41(56,57)58/h2-17,21,33H,18-19H2,1H3/b15-14+,17-16+
SMILES	Cc1nc2ccccc2nc1/C=C/c1nc2ccccc2nc1/C=C/c1nc2ccccc2nc1C1OCC(CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)O1
InChI Key	PJSXBWDVIGHOEZ-JLXBFWJWSA-N
Molecular Formula	C41H25F17N6O2
Exact Mass	956.657 g/mol

Data and Resources

2-(4-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptade...HTML
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Related Resources

This dataset related as HasPart to https://dx.doi.org/10.14272/PJSXBWDVIGHOEZ-JLXBFWJWSA-N/CHMO0001146
This dataset related as HasPart to https://dx.doi.org/10.14272/PJSXBWDVIGHOEZ-JLXBFWJWSA-N/CHMO0000292.1
This dataset related as HasPart to https://dx.doi.org/10.14272/PJSXBWDVIGHOEZ-JLXBFWJWSA-N/CHMO0000630
This dataset related as HasPart to https://dx.doi.org/10.14272/PJSXBWDVIGHOEZ-JLXBFWJWSA-N/CHMO0000470
This dataset related as HasPart to https://dx.doi.org/10.14272/PJSXBWDVIGHOEZ-JLXBFWJWSA-N/CHMO0000593
This dataset related as HasPart to https://dx.doi.org/10.14272/PJSXBWDVIGHOEZ-JLXBFWJWSA-N/CHMO0000597
This dataset related as HasPart to https://dx.doi.org/10.14272/PJSXBWDVIGHOEZ-JLXBFWJWSA-N/CHMO0000595
This dataset related as HasPart to https://dx.doi.org/10.14272/PJSXBWDVIGHOEZ-JLXBFWJWSA-N/CHMO0000292
This dataset related as HasPart to https://dx.doi.org/10.14272/PJSXBWDVIGHOEZ-JLXBFWJWSA-N/CHMO0000596.1
This dataset related as HasPart to https://dx.doi.org/10.14272/PJSXBWDVIGHOEZ-JLXBFWJWSA-N/CHMO0001150
This dataset related as HasPart to https://dx.doi.org/10.14272/PJSXBWDVIGHOEZ-JLXBFWJWSA-N/CHMO0000596
This dataset related as IsPartOf to https://dx.doi.org/10.14272/reaction/SA-FUHFF-UHFFFADPSC-PJSXBWDVIG-UHFFFADPSC-NUHFF-NNUFI-NUHFF-ZZZ

Metadata Information

Field	Value
DOI
License URL
Source
Version
Author	Klein, Jérôme
Maintainer	chemotion.net
Language	en
MetadataCreated	2022-10-06T14:10:41.454424
MetadataModified	2022-10-06T14:10:41.454429
MetadataPublished

Field	Value
Measurement Technique
Measurement Variables