Dataset

7c_JCAMP.

Chemical Info

InChI	InChI=1S/C17H30O2/c1-2-3-4-5-6-7-8-9-10-11-13-16(18)17-14-12-15-19-17/h12,14-16,18H,2-11,13H2,1H3
SMILES	CCCCCCCCCCCCC(O)C1=CC=CO1
InChI Key	KWSOXPPLWZODNZ-UHFFFAOYSA-N
Molecular Formula	C17H30O2
Exact Mass	266.400 g/mol

Data and Resources

• 7c_JCAMP.HTML
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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.57992/nmrxiv.p57.s331.d1855
License URL	https://creativecommons.org/licenses/by/4.0/legalcode
Source	https://nmrxiv.org/D1855
Version
Author	Toni Ditfe, Dr. Eileen Bette, Dr. Haider N. Sultani, Dr. Alexander Otto, Prof. Dr. Ludger A. Wessjohann, Dr. Norbert Arnold, Prof. Dr. Bernhard Westermann
Maintainer
Language	english
MetadataCreated	2024-05-15T08:44:29.646307
MetadataModified	2025-02-03T15:58:35.400363
MetadataPublished	2024-01-19 09:20:10
Related Molecule

Field	Value
Measurement Technique
Measurement Variables	NMR solvent : cdcl3 acquisition nucleus : 13C NMR spectrum by dimensionality : 1 NMR probe : Temperature : K magnetic field strength : Tesla number of scans : scans nuclear magnetic resonance pulse sequence : s2pul Spectral Width : number of data points : 65536 points relaxation time measurement : seconds

Data-Source Molecule ID	Data-Source
103910024	PubChem: Thomson Pharma
15721351	PubChem
J718.949D	Nikkaji
The data in this table is sourced from UniChem at EBI.