Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C15H10N2S/c1-10-2-7-13-14(8-10)18-15(17-13)12-5-3-11(9-16)4-6-12/h2-8H,1H3
SMILES	N#Cc1ccc(cc1)c1nc2c(s1)cc(cc2)C
InChI Key	MHUTZKFXGAZXEC-UHFFFAOYSA-N
Molecular Formula	C15H10N2S
Exact Mass	250.318 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/MHUTZKFXGAZXEC-UHFFFAOYSA-N/CHMO0000470.1
License URL
Source	https://www.chemotion-repository.net/inchikey/MHUTZKFXGAZXEC-UHFFFAOYSA-N/CHMO0000470.1
Version
Author	Simone Gräßle
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T01:52:27.977582
MetadataModified	2024-09-07T16:14:15.046672
MetadataPublished	2019-12-13

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
83394346	PubChem
The data in this table is sourced from UniChem at EBI.