Dataset

infrared absorption spectroscopy (IR)

Chemical Info

InChI	InChI=1S/C17H22O3/c1-6-7-8-13-9-14-12(4)15(19-5)10(2)11(3)16(14)20-17(13)18/h9H,6-8H2,1-5H3
SMILES	CCCCc1cc2c(C)c(OC)c(c(c2oc1=O)C)C
InChI Key	OYKLQGVMJMPACF-UHFFFAOYSA-N
Molecular Formula	C17H22O3
Exact Mass	274.355 g/mol

Data and Resources

• infrared absorption spectroscopy (IR)HTML
  Explore

  • More information
  • Go to resource

• infrared-absorption...

Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/OYKLQGVMJMPACF-UHFFFAOYSA-N/IR
License URL
Source	https://www.chemotion-repository.net/inchikey/OYKLQGVMJMPACF-UHFFFAOYSA-N/IR
Version
Author	Stefan Bräse
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T01:17:27.310018
MetadataModified	2024-09-07T15:23:22.357800
MetadataPublished	2019-06-27

Field	Value
Measurement Technique	infrared absorption spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
138453530	PubChem
The data in this table is sourced from UniChem at EBI.