Dataset

infrared absorption spectroscopy (IR)

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

Chemical Info

molecular Image
InChI InChI=1S/C27H40N4O5/c1-7-16(2)22-26(35)31-14-8-9-21(31)25(34)28-17(3)23(32)29-20(24(33)30-22)15-18-10-12-19(13-11-18)36-27(4,5)6/h10-13,16-17,20-22H,7-9,14-15H2,1-6H3,(H,28,34)(H,29,32)(H,30,33)/t16-,17+,20+,21-,22+/m1/s1
SMILES CC[C@H]([C@@H]1NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]2N(C1=O)CCC2)C)Cc1ccc(cc1)OC(C)(C)C)C
InChI Key GFWPHXLFIUZHAB-CYOIZWBSSA-N
Molecular Formula C27H40N4O5
Exact Mass 500.630 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/GFWPHXLFIUZHAB-CYOIZWBSSA-N/IR
License URL
Source https://www.chemotion-repository.net/inchikey/GFWPHXLFIUZHAB-CYOIZWBSSA-N/IR
Version
Author Stefan Bräse
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T01:19:01.200186
MetadataModified 2024-09-07T15:25:38.713393
MetadataPublished 2019-06-27
Field Value
Measurement Technique infrared absorption spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
No additional information available for this Dataset.