Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Info

InChI	InChI=1S/C29H14F8N6O4/c1-29(2,11-3-7-13(8-4-11)46-27(44)15-17(30)21(34)25(40-42-38)22(35)18(15)31)12-5-9-14(10-6-12)47-28(45)16-19(32)23(36)26(41-43-39)24(37)20(16)33/h3-10H,1-2H3
SMILES	O=C(c1c(F)c(F)c(c(c1F)F)N=[N+]=[N-])Oc1ccc(cc1)C(c1ccc(cc1)OC(=O)c1c(F)c(F)c(c(c1F)F)N=[N+]=[N-])(C)C
InChI Key	LFTBPIVRRIXEJP-UHFFFAOYSA-N
Molecular Formula	C29H14F8N6O4
Exact Mass	662.446 g/mol

Data and Resources

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Metadata Information

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• Measurement

Field	Value
DOI	10.14272/LFTBPIVRRIXEJP-UHFFFAOYSA-N/CHMO0000595
License URL
Source	https://www.chemotion-repository.net/inchikey/LFTBPIVRRIXEJP-UHFFFAOYSA-N/CHMO0000595
Version
Author	Lisa Schmidt
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T02:02:46.301475
MetadataModified	2024-09-08T02:02:46.301480
MetadataPublished	2023-12-05

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