Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C19H17N5O/c1-25-17-9-7-16(8-10-17)18-14-24(22-20-18)19-11-12-23(21-19)13-15-5-3-2-4-6-15/h2-12,14H,13H2,1H3
SMILES	COc1ccc(cc1)c1nnn(c1)c1ccn(n1)Cc1ccccc1
InChI Key	JMPSOWDQCFVJPL-UHFFFAOYSA-N
Molecular Formula	C19H17N5O
Exact Mass	331.371 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/JMPSOWDQCFVJPL-UHFFFAOYSA-N/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/JMPSOWDQCFVJPL-UHFFFAOYSA-N/CHMO0000470
Version
Author	Nicolai Wippert
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T02:28:16.081095
MetadataModified	2024-09-08T02:28:16.081100
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.