Dataset
high-resolution mass spectrometry (HRMS)
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) |
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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
Metadata Information
Field | Value |
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DOI | 10.14272/TWIAJLZWOOVMTF-UHFFFAOYSA-N/CHMO0000498 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/TWIAJLZWOOVMTF-UHFFFAOYSA-N/CHMO0000498 |
Version | |
Author | Michael Mertens |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2025-01-29T10:54:26.385621 |
MetadataModified | 2025-01-29T16:46:18.543396 |
MetadataPublished | 2024-12-03 |
Related Molecule |
Field | Value |
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Measurement Technique | high-resolution mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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No additional information available for this Dataset. |