Dataset

infrared absorption spectroscopy (IR)

Chemical Info

InChI	InChI=1S/C15H18O4/c1-4-6-10-7-12-13(17-3)8-11(18-5-2)9-14(12)19-15(10)16/h7-9H,4-6H2,1-3H3
SMILES	CCCc1cc2c(OC)cc(cc2oc1=O)OCC
InChI Key	DHWWIODBWJXCME-UHFFFAOYSA-N
Molecular Formula	C15H18O4
Exact Mass	262.301 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/DHWWIODBWJXCME-UHFFFAOYSA-N/IR
License URL
Source	https://www.chemotion-repository.net/inchikey/DHWWIODBWJXCME-UHFFFAOYSA-N/IR
Version
Author	Stefan Bräse
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T01:23:41.451134
MetadataModified	2024-09-07T15:32:29.272494
MetadataPublished	2019-06-27

Field	Value
Measurement Technique	infrared absorption spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
138453634	PubChem
The data in this table is sourced from UniChem at EBI.