Dataset

infrared absorption spectroscopy (IR)

Chemical Info

InChI	InChI=1S/C36H40N2O6/c1-7-35(5,6)36-22-29(30(39)42-23-25-16-10-8-11-17-25)38(32(40)43-24-26-18-12-9-13-19-26)31(36)37(33(41)44-34(2,3)4)28-21-15-14-20-27(28)36/h7-21,29,31H,1,22-24H2,2-6H3/t29-,31-,36+/m0/s1
SMILES	C=CC([C@]12C[C@H](N([C@@H]2N(c2c1cccc2)C(=O)OC(C)(C)C)C(=O)OCc1ccccc1)C(=O)OCc1ccccc1)(C)C
InChI Key	ITZZJANVOLUMTH-DDCZIVEXSA-N
Molecular Formula	C36H40N2O6
Exact Mass	596.713 g/mol

Data and Resources

• infrared absorption spectroscopy (IR)HTML
  Explore

  • More information
  • Go to resource

• infrared-absorption...

Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/ITZZJANVOLUMTH-DDCZIVEXSA-N/IR
License URL
Source	https://www.chemotion-repository.net/inchikey/ITZZJANVOLUMTH-DDCZIVEXSA-N/IR
Version
Author	Yu-Chieh Huang
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T01:11:29.748237
MetadataModified	2024-09-07T15:14:27.803387
MetadataPublished	2019-06-27
Related Molecule

Field	Value
Measurement Technique	infrared absorption spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
138453444	PubChem
The data in this table is sourced from UniChem at EBI.