Dataset

mass spectrometry (MS) ()

Chemical Info

InChI	InChI=1S/C18H13ClN6O2/c1-12-9-18(23-11-16(20-22-23)13-5-3-2-4-6-13)21-24(12)17-8-7-14(25(26)27)10-15(17)19/h2-11H,1H3
SMILES	Cc1cc(-n2cc(-c3ccccc3)nn2)nn1-c1ccc([N+](=O)[O-])cc1Cl
InChI Key	NASFABBFAHTRIZ-UHFFFAOYSA-N
Molecular Formula	C18H13ClN6O2

Data and Resources

• mass spectrometry (MS) ()HTML
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Related Resources

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

Metadata Information

• Additional
• Measurement

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by-sa/4.0
Source
Version
Author	Gräßle, Simone, Wippert, Nicolai
Maintainer	chemotion-repository
Language	en
MetadataCreated	2024-02-18T03:51:15.006106
MetadataModified	2024-02-18T03:51:15.006111
MetadataPublished

Field	Value
Measurement Technique
Measurement Variables