Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C19H26O3/c1-6-7-8-9-10-15-11-16-14(4)17(21-5)12(2)13(3)18(16)22-19(15)20/h11H,6-10H2,1-5H3
SMILES	CCCCCCc1cc2c(C)c(OC)c(c(c2oc1=O)C)C
InChI Key	IHWNLGXQAWTEIK-UHFFFAOYSA-N
Molecular Formula	C19H26O3
Exact Mass	302.408 g/mol

Data and Resources

• mass spectrometry (MS)HTML
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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/IHWNLGXQAWTEIK-UHFFFAOYSA-N/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/IHWNLGXQAWTEIK-UHFFFAOYSA-N/CHMO0000470
Version
Author	Florian Mohr
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T04:15:51.246971
MetadataModified	2024-09-07T19:24:43.868008
MetadataPublished	2021-03-01
Related Molecule

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
138453806	PubChem
The data in this table is sourced from UniChem at EBI.