Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C22H15N7O2/c1-14-10-20(25-29(14)17-8-6-15(11-23)7-9-17)28-13-16(24-26-28)12-27-21(30)18-4-2-3-5-19(18)22(27)31/h2-10,13H,12H2,1H3
SMILES	N#Cc1ccc(cc1)n1nc(cc1C)n1nnc(c1)CN1C(=O)c2c(C1=O)cccc2
InChI Key	DWYBPGPEFGKMQS-UHFFFAOYSA-N
Molecular Formula	C22H15N7O2
Exact Mass	409.400 g/mol

Data and Resources

• mass spectrometry (MS)HTML
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• mass-spectrometry

Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/DWYBPGPEFGKMQS-UHFFFAOYSA-N/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/DWYBPGPEFGKMQS-UHFFFAOYSA-N/CHMO0000470
Version
Author	Nicolai Wippert
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T03:00:41.994017
MetadataModified	2024-09-08T03:00:41.994023
MetadataPublished	2024-02-14

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
No additional information available for this Dataset.