Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C12H14N2O2/c1-8-11(12(15-2)16-3)14-10-7-5-4-6-9(10)13-8/h4-7,12H,1-3H3
SMILES	COC(c1nc2ccccc2nc1C)OC
InChI Key	UMFRPXCWGOHCRE-UHFFFAOYSA-N
Molecular Formula	C12H14N2O2
Exact Mass	218.252 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/UMFRPXCWGOHCRE-UHFFFAOYSA-N/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/UMFRPXCWGOHCRE-UHFFFAOYSA-N/CHMO0000470
Version
Author	Jérôme Klein
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T03:03:29.815858
MetadataModified	2024-09-08T03:03:29.815862
MetadataPublished	2024-02-15

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
No additional information available for this Dataset.