Dataset

infrared absorption spectroscopy (IR)

Chemical Info

InChI	InChI=1S/C17H10N4O2/c1-23-17(22)11-4-2-10(3-5-11)16-20-14-6-12(8-18)13(9-19)7-15(14)21-16/h2-7H,1H3,(H,20,21)
SMILES	COC(=O)c1ccc(cc1)c1nc2c([nH]1)cc(c(c2)C#N)C#N
InChI Key	BLFQAPUPZTZFGB-UHFFFAOYSA-N
Molecular Formula	C17H10N4O2
Exact Mass	302.287 g/mol

Data and Resources

• infrared absorption spectroscopy (IR)HTML
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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/BLFQAPUPZTZFGB-UHFFFAOYSA-N/CHMO0000630
License URL
Source	https://www.chemotion-repository.net/inchikey/BLFQAPUPZTZFGB-UHFFFAOYSA-N/CHMO0000630
Version
Author	Lukas Langer
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2025-03-08T03:05:42.490688
MetadataModified	2025-03-09T03:14:59.524004
MetadataPublished	2025-03-07
Related Molecule

Field	Value
Measurement Technique	infrared absorption spectroscopy
Measurement Variables

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