Dataset

infrared absorption spectroscopy (IR)

Chemical Info

InChI	InChI=1S/C15H16O2/c1-9-7-11-5-3-4-6-12(11)13-8-10(2)15(16)17-14(9)13/h7-8H,3-6H2,1-2H3
SMILES	O=c1oc2c(C)cc3c(c2cc1C)CCCC3
InChI Key	IAFUMXPXNNLVNE-UHFFFAOYSA-N
Molecular Formula	C15H16O2
Exact Mass	228.286 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/IAFUMXPXNNLVNE-UHFFFAOYSA-N/IR
License URL
Source	https://www.chemotion-repository.net/inchikey/IAFUMXPXNNLVNE-UHFFFAOYSA-N/IR
Version
Author	Yu-Chieh Huang
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T01:15:38.926296
MetadataModified	2024-09-07T15:20:41.524992
MetadataPublished	2019-06-27

Field	Value
Measurement Technique	infrared absorption spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
138453504	PubChem
The data in this table is sourced from UniChem at EBI.