Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C41H41NO4P.BrH/c1-2-45-40(43)30-42(41(44)46-31-39-37-26-14-12-24-35(37)36-25-13-15-27-38(36)39)28-16-17-29-47(32-18-6-3-7-19-32,33-20-8-4-9-21-33)34-22-10-5-11-23-34;/h3-15,18-27,39H,2,16-17,28-31H2,1H3;1H/q+1;/p-1
SMILES CCOC(=O)CN(C(=O)OCC1c2ccccc2-c2c1cccc2)CCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Br-]
InChI Key UHYDDOIFNOMWMG-UHFFFAOYSA-M
Molecular Formula C41H41BrNO4P
Exact Mass 722.646 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/UHYDDOIFNOMWMG-UHFFFAOYSA-M/IR
License URL
Source https://www.chemotion-repository.net/inchikey/UHYDDOIFNOMWMG-UHFFFAOYSA-M/IR
Version
Author Yu-Chieh Huang
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T01:14:14.087673
MetadataModified 2024-09-07T15:18:34.506115
MetadataPublished 2019-06-27
Related Molecule
Field Value
Measurement Technique infrared absorption spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
138453486 PubChem
The data in this table is sourced from UniChem at EBI.