Dataset

infrared absorption spectroscopy (IR)

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

Chemical Info

molecular Image
InChI InChI=1S/C28H22I2/c29-25-13-9-23(10-14-25)27-17-19-1-2-20-4-6-22(8-7-21(27)5-3-19)28(18-20)24-11-15-26(30)16-12-24/h3-6,9-18H,1-2,7-8H2
SMILES Ic1ccc(cc1)c1cc2ccc1CCc1ccc(CC2)cc1c1ccc(cc1)I
InChI Key YQTVOHOFVUOTPI-UHFFFAOYSA-N
Molecular Formula C28H22I2
Exact Mass 612.283 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/YQTVOHOFVUOTPI-UHFFFAOYSA-N/CHMO0000630.1
License URL
Source https://www.chemotion-repository.net/inchikey/YQTVOHOFVUOTPI-UHFFFAOYSA-N/CHMO0000630.1
Version
Author Henrik Tappert
Maintainer Chemotion Repository
Language english
MetadataCreated 2025-02-25T11:54:06.124437
MetadataModified 2025-02-25T12:00:51.180176
MetadataPublished
Related Molecule