Dataset

mass spectrometry (MS) (3-[4-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluorononyl)-1,3-dioxolan-2-yl]quinoxaline-2-carbaldehyde)

Chemical Info

InChI	InChI=1S/C21H11F17N2O3/c22-14(23,5-8-7-42-13(43-8)12-11(6-41)39-9-3-1-2-4-10(9)40-12)15(24,25)16(26,27)17(28,29)18(30,31)19(32,33)20(34,35)21(36,37)38/h1-4,6,8,13H,5,7H2
SMILES	O=Cc1nc2ccccc2nc1C1OCC(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	IBDTXQKORWUHSR-UHFFFAOYSA-N
Molecular Formula	C21H11F17N2O3
Exact Mass	662.296 g/mol

Data and Resources

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Related Resources

• This dataset related as IsPartOf to https://dx.doi.org/10.14272/IBDTXQKORWUHSR-UHFFFAOYSA-N.1

Metadata Information

• Additional
• Measurement

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by-sa/4.0
Source
Version
Author	Klein, Jérôme
Maintainer	chemotion.net
Language	en
MetadataCreated	2022-10-06T14:14:53.949693
MetadataModified	2022-10-06T14:14:53.949698
MetadataPublished

Field	Value
Measurement Technique
Measurement Variables