Dataset

mass spectrometry (MS)

dataset for mass spectrometry (MS)

Chemical Information

molecular Image
InChI InChI=1S/C38H42N2O4/c1-37(2,3)43-35(41)39-31-19-15-29(16-20-31)33-23-25-7-8-26-10-12-28(14-13-27(33)11-9-25)34(24-26)30-17-21-32(22-18-30)40-36(42)44-38(4,5)6/h9-12,15-24H,7-8,13-14H2,1-6H3,(H,39,41)(H,40,42)
SMILES O=C(OC(C)(C)C)Nc1ccc(cc1)c1cc2ccc1CCc1ccc(CC2)cc1c1ccc(cc1)NC(=O)OC(C)(C)C
InChI Key WFUQCMINPMPIEV-UHFFFAOYSA-N
Exact Mass 590.751 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/WFUQCMINPMPIEV-UHFFFAOYSA-N/CHMO0000470
License URL
Source https://www.chemotion-repository.net/inchikey/WFUQCMINPMPIEV-UHFFFAOYSA-N/CHMO0000470
Version
Author Yuting Li
Maintainer Chemotion Repository
Language english
MetadataPublished 2026-03-17
Related Molecule
Field Value
Measurement Technique mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
No additional information available for this Dataset.