Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Info

InChI	InChI=1S/C20H22O/c1-14(2)20(21)19-13-17-8-7-15-3-5-16(6-4-15)9-11-18(19)12-10-17/h3-6,10,12-14H,7-9,11H2,1-2H3
SMILES	CC(C(=O)c1cc2CCc3ccc(CCc1cc2)cc3)C
InChI Key	WTMBTNXPPIBZFI-UHFFFAOYSA-N
Molecular Formula	C20H22O
Exact Mass	278.388 g/mol

Data and Resources

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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/WTMBTNXPPIBZFI-UHFFFAOYSA-N/CHMO0000593
License URL
Source	https://www.chemotion-repository.net/inchikey/WTMBTNXPPIBZFI-UHFFFAOYSA-N/CHMO0000593
Version
Author	Christoph Zippel
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T04:40:56.994021
MetadataModified	2024-09-07T19:56:54.654912
MetadataPublished	2021-06-11
Related Molecule

Field	Value
Measurement Technique	1H nuclear magnetic resonance spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
155921397	PubChem
The data in this table is sourced from UniChem at EBI.