Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C16H20O3/c1-6-7-12-8-13-11(4)14(18-5)9(2)10(3)15(13)19-16(12)17/h8H,6-7H2,1-5H3
SMILES	CCCc1cc2c(C)c(OC)c(c(c2oc1=O)C)C
InChI Key	UBWZLOPDHGEVCS-UHFFFAOYSA-N
Molecular Formula	C16H20O3
Exact Mass	260.328 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/UBWZLOPDHGEVCS-UHFFFAOYSA-N/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/UBWZLOPDHGEVCS-UHFFFAOYSA-N/CHMO0000470
Version
Author	Florian Mohr
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T04:17:25.386798
MetadataModified	2024-09-07T19:26:47.446677
MetadataPublished	2021-03-01
Related Molecule

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
138453828	PubChem
The data in this table is sourced from UniChem at EBI.