Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C19H16BrN5O/c1-26-17-8-4-15(5-9-17)18-13-25(23-21-18)19-10-11-24(22-19)12-14-2-6-16(20)7-3-14/h2-11,13H,12H2,1H3
SMILES	COc1ccc(cc1)c1nnn(c1)c1ccn(n1)Cc1ccc(cc1)Br
InChI Key	QXNOXDRDOZJZFO-UHFFFAOYSA-N
Molecular Formula	C19H16BrN5O
Exact Mass	410.267 g/mol

Data and Resources

• mass spectrometry (MS)HTML
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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/QXNOXDRDOZJZFO-UHFFFAOYSA-N/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/QXNOXDRDOZJZFO-UHFFFAOYSA-N/CHMO0000470
Version
Author	Nicolai Wippert
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T02:57:27.165819
MetadataModified	2024-09-08T02:57:27.165823
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.