Dataset

1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)

Chemical Info

InChI	InChI=1S/C20H20O3/c1-12(2)17-9-4-13(3)19-18(17)11-15(20(22)23-19)10-14-5-7-16(21)8-6-14/h4-9,11-12,21H,10H2,1-3H3
SMILES	Oc1ccc(cc1)Cc1cc2c(ccc(c2oc1=O)C)C(C)C
InChI Key	VFJCNECVCLZJMX-UHFFFAOYSA-N
Molecular Formula	C20H20O3
Exact Mass	308.371 g/mol

Data and Resources

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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/VFJCNECVCLZJMX-UHFFFAOYSA-N/CHMO0001148
License URL
Source	https://www.chemotion-repository.net/inchikey/VFJCNECVCLZJMX-UHFFFAOYSA-N/CHMO0001148
Version
Author	Sylvia Vanderheiden-Schroen
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T05:19:14.919189
MetadataModified	2024-09-07T20:46:19.491911
MetadataPublished	2021-12-17
Related Molecule

Field	Value
Measurement Technique	1H–13C heteronuclear multiple bond coherence
Measurement Variables

Data-Source Molecule ID	Data-Source
162368968	PubChem
The data in this table is sourced from UniChem at EBI.