Dataset

mass spectrometry (MS) ()

Chemical Info

InChI	InChI=1S/C18H18BrN5O4/c1-3-27-18(26)16-10-23(8-13-4-6-14(19)7-5-13)21-17(16)24-9-15(20-22-24)11-28-12(2)25/h4-7,9-10H,3,8,11H2,1-2H3
SMILES	CCOC(=O)c1cn(Cc2ccc(Br)cc2)nc1-n1cc(COC(C)=O)nn1
InChI Key	JIGNGCLNWAMKPG-UHFFFAOYSA-N
Molecular Formula	C18H18BrN5O4

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/JIGNGCLNWAMKPG-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	2024-02-18T03:49:29.880064
MetadataModified	2024-02-18T03:49:29.880070
MetadataPublished

Field	Value
Measurement Technique
Measurement Variables