Dataset

infrared absorption spectroscopy (IR)

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

Chemical Info

molecular Image
InChI InChI=1S/C23H23NO6/c1-5-10-29-23(26)24(2)17-13-20(28-4)18-12-16(22(25)30-21(18)14-17)11-15-8-6-7-9-19(15)27-3/h5-9,12-14H,1,10-11H2,2-4H3
SMILES C=CCOC(=O)N(c1cc(OC)c2c(c1)oc(=O)c(c2)Cc1ccccc1OC)C
InChI Key AWRHIKJVOFAHAE-UHFFFAOYSA-N
Molecular Formula C23H23NO6
Exact Mass 409.432 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/AWRHIKJVOFAHAE-UHFFFAOYSA-N/IR
License URL
Source https://www.chemotion-repository.net/inchikey/AWRHIKJVOFAHAE-UHFFFAOYSA-N/IR
Version
Author Stefan Bräse
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T01:32:49.873578
MetadataModified 2024-09-07T15:46:13.656694
MetadataPublished 2019-06-27
Related Molecule
Field Value
Measurement Technique infrared absorption spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
138453761 PubChem
The data in this table is sourced from UniChem at EBI.