Dataset

infrared absorption spectroscopy (IR)

Chemical Info

InChI	InChI=1S/C15H17NO/c1-3-5-9-16-10-8-13-12-14(17-11-4-2)6-7-15(13)16/h2,6-8,10,12H,3,5,9,11H2,1H3
SMILES	CCCCn1ccc2c1ccc(c2)OCC#C
InChI Key	OHTAZUMSCVDNAC-UHFFFAOYSA-N
Molecular Formula	C15H17NO
Exact Mass	227.302 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/OHTAZUMSCVDNAC-UHFFFAOYSA-N/IR
License URL
Source	https://www.chemotion-repository.net/inchikey/OHTAZUMSCVDNAC-UHFFFAOYSA-N/IR
Version
Author	Yu-Chieh Huang
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T01:22:12.284444
MetadataModified	2024-09-07T15:30:20.633320
MetadataPublished	2019-06-27

Field	Value
Measurement Technique	infrared absorption spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
138453611	PubChem
The data in this table is sourced from UniChem at EBI.