Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C9H8N2O/c1-6-9(12)11-8-5-3-2-4-7(8)10-6/h2-5H,1H3,(H,11,12)
SMILES	O=c1[nH]c2ccccc2nc1C
InChI Key	BMIMNRPAEPIYDN-UHFFFAOYSA-N
Molecular Formula	C9H8N2O
Exact Mass	160.173 g/mol

Data and Resources

• mass spectrometry (MS)HTML
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• mass-spectrometry

Metadata Information

• Additional
• Measurement

Field	Value
DOI	10.14272/BMIMNRPAEPIYDN-UHFFFAOYSA-N/CHMO0000470.1
License URL
Source	https://www.chemotion-repository.net/inchikey/BMIMNRPAEPIYDN-UHFFFAOYSA-N/CHMO0000470.1
Version
Author	Jérôme Klein
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T03:16:26.928719
MetadataModified	2024-09-07T18:06:38.444732
MetadataPublished	2020-05-14

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables