Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Info

InChI	InChI=1S/C28H24F2N3.HI/c1-33-15-13-22(14-16-33)24-17-19-5-9-21(24)10-6-20-8-12-23(11-7-19)27(18-20)31-32-28-25(29)3-2-4-26(28)30;/h2-5,8-9,12-18H,6-7,10-11H2,1H3;1H/q+1;/p-1/b32-31+;
SMILES	C[n+]1ccc(cc1)c1cc2CCc3ccc(CCc1cc2)cc3/N=N/c1c(F)cccc1F.[I-]
InChI Key	JDTNNFQGVPIDIT-MRRLHAJBSA-M
Molecular Formula	C28H24F2IN3
Exact Mass	567.412 g/mol

Data and Resources

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Metadata Information

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• Measurement

Field	Value
DOI	10.14272/JDTNNFQGVPIDIT-MRRLHAJBSA-M/CHMO0000595
License URL
Source	https://www.chemotion-repository.net/inchikey/JDTNNFQGVPIDIT-MRRLHAJBSA-M/CHMO0000595
Version
Author	Yichuan Wang
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T04:05:12.659941
MetadataModified	2024-09-08T04:05:12.659947
MetadataPublished	2024-07-10

Field	Value
Measurement Technique	13C nuclear magnetic resonance spectroscopy
Measurement Variables