Dataset

infrared absorption spectroscopy (IR)

Chemical Info

InChI	InChI=1S/C37H36N2O6Se/c1-36(2,3)45-35(42)38-30-22-14-13-21-29(30)37(46-28-19-11-6-12-20-28)23-31(32(40)43-24-26-15-7-4-8-16-26)39(33(37)38)34(41)44-25-27-17-9-5-10-18-27/h4-22,31,33H,23-25H2,1-3H3/t31-,33-,37+/m0/s1
SMILES	O=C([C@@H]1C[C@@]2([C@H](N1C(=O)OCc1ccccc1)N(c1c2cccc1)C(=O)OC(C)(C)C)[Se]c1ccccc1)OCc1ccccc1
InChI Key	DPWJWFIZCPGANH-MSQJTAOTSA-N
Molecular Formula	C37H36N2O6Se
Exact Mass	683.652 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/DPWJWFIZCPGANH-MSQJTAOTSA-N/IR
License URL
Source	https://www.chemotion-repository.net/inchikey/DPWJWFIZCPGANH-MSQJTAOTSA-N/IR
Version
Author	Yu-Chieh Huang
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T01:10:55.991182
MetadataModified	2024-09-07T15:13:38.573720
MetadataPublished	2019-06-27
Related Molecule

Field	Value
Measurement Technique	infrared absorption spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
138453439	PubChem
The data in this table is sourced from UniChem at EBI.