Dataset

infrared absorption spectroscopy (IR)

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

Chemical Info

molecular Image
InChI InChI=1S/C18H16O6/c1-23-17(21)13-7-3-11(4-8-13)15(19)16(20)12-5-9-14(10-6-12)18(22)24-2/h3-10,15,19H,1-2H3
SMILES COC(=O)c1ccc(cc1)C(=O)C(c1ccc(cc1)C(=O)OC)O
InChI Key XFRIKHRKYHJNTP-UHFFFAOYSA-N
Molecular Formula C18H16O6
Exact Mass 328.316 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/XFRIKHRKYHJNTP-UHFFFAOYSA-N/CHMO0000630
License URL
Source https://www.chemotion-repository.net/inchikey/XFRIKHRKYHJNTP-UHFFFAOYSA-N/CHMO0000630
Version
Author Simon Oßwald
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T02:45:24.624837
MetadataModified 2024-09-07T17:24:29.935220
MetadataPublished 2020-03-31
Field Value
Measurement Technique infrared absorption spectroscopy
Measurement Variables