Dataset
infrared absorption spectroscopy (IR)
Chemical Info
| InChI | InChI=1S/C28H22I2/c29-25-13-9-23(10-14-25)27-17-19-1-5-21(27)8-4-20-2-6-22(7-3-19)28(18-20)24-11-15-26(30)16-12-24/h1-2,5-6,9-18H,3-4,7-8H2 |
|---|---|
| SMILES | Ic1ccc(cc1)c1cc2CCc3ccc(CCc1cc2)cc3c1ccc(cc1)I |
| InChI Key | FNQCIKYPHCWPGB-UHFFFAOYSA-N |
| Molecular Formula | C28H22I2 |
| Exact Mass | 612.283 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/FNQCIKYPHCWPGB-UHFFFAOYSA-N/CHMO0000630.1 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/FNQCIKYPHCWPGB-UHFFFAOYSA-N/CHMO0000630.1 |
| Version | |
| Author | Henrik Tappert |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataCreated | 2025-02-25T11:54:19.315938 |
| MetadataModified | 2025-02-25T12:01:03.956758 |
| MetadataPublished | |
| Related Molecule |