Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C11H8N2/c1-3-9-8(2)12-10-6-4-5-7-11(10)13-9/h1,4-7H,2H3
SMILES	C#Cc1nc2ccccc2nc1C
InChI Key	MEQYZKGJBBXONM-UHFFFAOYSA-N
Molecular Formula	C11H8N2
Exact Mass	168.195 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/MEQYZKGJBBXONM-UHFFFAOYSA-N/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/MEQYZKGJBBXONM-UHFFFAOYSA-N/CHMO0000470
Version
Author	Victor Larignon
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T04:28:17.175084
MetadataModified	2024-09-07T19:40:44.643082
MetadataPublished	2021-05-13
Related Molecule

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
122241558	PubChem
ZINC000585145306	ZINC
The data in this table is sourced from UniChem at EBI.