Dataset

infrared absorption spectroscopy (IR)

Chemical Info

InChI	InChI=1S/C38H36N2O6Se/c1-37(2,3)46-36(43)39-31-21-13-12-20-30(31)38(47-24-14-6-5-7-15-24)22-32(33(41)44-4)40(34(38)39)35(42)45-23-29-27-18-10-8-16-25(27)26-17-9-11-19-28(26)29/h5-21,29,32,34H,22-23H2,1-4H3/t32-,34?,38?/m0/s1
SMILES	COC(=O)[C@@H]1CC2(C(N1C(=O)OCC1c3ccccc3-c3c1cccc3)N(c1c2cccc1)C(=O)OC(C)(C)C)[Se]c1ccccc1
InChI Key	GXPFRYDFZXTOEH-ARLVUHNPSA-N
Molecular Formula	C38H36N2O6Se
Exact Mass	695.662 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/GXPFRYDFZXTOEH-ARLVUHNPSA-N/IR
License URL
Source	https://www.chemotion-repository.net/inchikey/GXPFRYDFZXTOEH-ARLVUHNPSA-N/IR
Version
Author	Yu-Chieh Huang
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T01:11:18.251585
MetadataModified	2024-09-07T15:14:10.597654
MetadataPublished	2019-06-27
Related Molecule

Field	Value
Measurement Technique	infrared absorption spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
138453442	PubChem
The data in this table is sourced from UniChem at EBI.