Dataset

infrared absorption spectroscopy (IR)

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

Chemical Info

molecular Image
InChI InChI=1S/C23H34O3/c1-22-9-7-16(24)12-15(22)3-4-17-19-6-5-18(14-11-21(25)26-13-14)23(19,2)10-8-20(17)22/h11,15-20,24H,3-10,12-13H2,1-2H3/t15-,16-,17-,18?,19-,20-,22-,23+/m0/s1
SMILES O[C@H]1CC[C@]2([C@H](C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CCC2C1=CC(=O)OC1)C)C
InChI Key SNNJOYYRZHOKFM-PRIJSRMQSA-N
Molecular Formula C23H34O3
Exact Mass 358.514 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/SNNJOYYRZHOKFM-PRIJSRMQSA-N/IR
License URL
Source https://www.chemotion-repository.net/inchikey/SNNJOYYRZHOKFM-PRIJSRMQSA-N/IR
Version
Author Stefan Bräse
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T01:13:50.410758
MetadataModified 2024-09-07T15:17:59.147531
MetadataPublished 2019-06-27
Field Value
Measurement Technique infrared absorption spectroscopy
Measurement Variables