Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Information

InChI	InChI=1S/C25H30O4/c1-4-5-6-7-12-25(2,3)19-15-22(27)21-14-18(24(28)29-23(21)16-19)13-17-8-10-20(26)11-9-17/h8-11,14-16,26-27H,4-7,12-13H2,1-3H3
SMILES	CCCCCCC(c1cc(O)c2c(c1)oc(=O)c(c2)Cc1ccc(cc1)O)(C)C
InChI Key	LTCXBULBIGDICA-UHFFFAOYSA-N
Exact Mass	394.503 g/mol

Data and Resources

• 1H nuclear magnetic resonance spectroscopy (1H NMR)HTML
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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/LTCXBULBIGDICA-UHFFFAOYSA-N/CHMO0000593
License URL
Source	https://www.chemotion-repository.net/inchikey/LTCXBULBIGDICA-UHFFFAOYSA-N/CHMO0000593
Version
Author	Florian Mohr
Maintainer	Chemotion Repository
Language	english
MetadataPublished	2026-04-28T13:07:42Z
Related Molecule

Field	Value
Measurement Technique	1H nuclear magnetic resonance spectroscopy
Measurement Variables	Date : 2019-03-07 Starting time : 23:35:59 UTC Creator : Florian Mohr label : FDM-266 id : 58005 Solvent used for referencing : Acetone temperature : 297.9995 K PULPROG : zg30 number of scans : 16 scans instrument : spect Name : Parameter file, TOPSPIN Version 3.2 Version : Parameter file, TOPSPIN Version 3.2

Data-Source Molecule ID	Data-Source
No additional information available for this Dataset.