Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Info

InChI	InChI=1S/C29H41N3O5/c1-23(33)32(21-11-9-19-31-28(35)37-29(2,3)4)20-10-8-18-30-27(34)25-14-16-26(17-15-25)36-22-24-12-6-5-7-13-24/h5-7,12-17H,8-11,18-22H2,1-4H3,(H,30,34)(H,31,35)
SMILES	O=C(OC(C)(C)C)NCCCCN(C(=O)C)CCCCNC(=O)c1ccc(cc1)OCc1ccccc1
InChI Key	TWIAJLZWOOVMTF-UHFFFAOYSA-N
Molecular Formula	C29H41N3O5
Exact Mass	511.653 g/mol

Data and Resources

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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/TWIAJLZWOOVMTF-UHFFFAOYSA-N/CHMO0000595
License URL
Source	https://www.chemotion-repository.net/inchikey/TWIAJLZWOOVMTF-UHFFFAOYSA-N/CHMO0000595
Version
Author	Michael Mertens
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2025-01-29T10:54:23.662176
MetadataModified	2025-01-29T16:46:15.570720
MetadataPublished	2024-12-03
Related Molecule

Field	Value
Measurement Technique	13C nuclear magnetic resonance spectroscopy
Measurement Variables	Temperature : 297.9 K K Puls programme : zgpg30 Number of scans : 1024 Title : Mertens Date : 20240830 Start time : 11.22 h Instrument : spect Label : MWM-73 ID : 128187 Solvent : chloroform-D1 (CDCl3)

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