Dataset

attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)

dataset for attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C29H48O2/c1-16(2)26(30)20-13-19(20)17(3)22-7-8-23-21-14-25(31-6)29-15-18(29)9-12-28(29,5)24(21)10-11-27(22,23)4/h16-26,30H,7-15H2,1-6H3/t17-,18-,19-,20+,21+,22-,23+,24+,25-,26?,27-,28-,29+/m1/s1
SMILES CO[C@@H]1C[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@@]31C[C@H]3CC2)C)[C@@H]([C@H]1C[C@@H]1C(C(C)C)O)C
InChI Key OCLGZDCBOFTXRM-PIACRFSQSA-N
Molecular Formula C29H48O2
Exact Mass 428.690 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/OCLGZDCBOFTXRM-PIACRFSQSA-N/CHMO0000763
License URL
Source https://www.chemotion-repository.net/inchikey/OCLGZDCBOFTXRM-PIACRFSQSA-N/CHMO0000763
Version
Author Nicolai Rosenbaum
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T04:22:31.484684
MetadataModified 2024-09-07T19:33:30.651311
MetadataPublished 2021-03-16
Field Value
Measurement Technique attenuated total reflectance Fourier transform infrared spectroscopy
Measurement Variables