Dataset

infrared absorption spectroscopy (IR)

Chemical Info

InChI	InChI=1S/C31H32N2O6/c1-31(2,3)39-30(36)33-19-24(25-16-10-11-17-27(25)33)18-26(28(34)37-20-22-12-6-4-7-13-22)32-29(35)38-21-23-14-8-5-9-15-23/h4-17,19,26H,18,20-21H2,1-3H3,(H,32,35)/t26-/m0/s1
SMILES	O=C(N[C@H](C(=O)OCc1ccccc1)Cc1cn(c2c1cccc2)C(=O)OC(C)(C)C)OCc1ccccc1
InChI Key	KVGMNWHILJDXCC-SANMLTNESA-N
Molecular Formula	C31H32N2O6
Exact Mass	528.596 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/KVGMNWHILJDXCC-SANMLTNESA-N/IR
License URL
Source	https://www.chemotion-repository.net/inchikey/KVGMNWHILJDXCC-SANMLTNESA-N/IR
Version
Author	Yu-Chieh Huang
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T01:10:51.073946
MetadataModified	2024-09-07T15:13:31.439830
MetadataPublished	2019-06-27
Related Molecule

Field	Value
Measurement Technique	infrared absorption spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
138453438	PubChem
The data in this table is sourced from UniChem at EBI.