Dataset

mass spectrometry (MS) ()

Chemical Info

InChI	InChI=1S/C11H8N2/c1-2-9-7-13-11-4-3-8(6-12)5-10(9)11/h2-5,7,13H,1H2
SMILES	C=Cc1c[nH]c2ccc(C#N)cc12
InChI Key	OHIGKOFNMGVKOJ-UHFFFAOYSA-N
Exact Mass	168.19899999999998 g/mol

Data and Resources

• mass spectrometry (MS) ()HTML
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• chemistry
• mass-spectrometry

Related Resources

• This dataset related as IsPartOf to https://dx.doi.org/10.14272/OHIGKOFNMGVKOJ-UHFFFAOYSA-N.1

Metadata Information

• Additional
• Measurement

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by/4.0
Source
Version
Author	Gräßle, Simone
Maintainer	chemotion-repository
Language	en
Measurement Technique IRI
MetadataCreated	2023-11-19T03:10:21.008533
MetadataModified	2023-11-19T03:10:21.008537
MetadataPublished

Field	Value
Measurement Technique
Measurement Variables