Dataset

infrared absorption spectroscopy (IR)

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

Chemical Info

molecular Image
InChI InChI=1S/C9H10O4/c1-12-6-3-8(11)7(5-10)9(4-6)13-2/h3-5,11H,1-2H3
SMILES COc1cc(OC)cc(c1C=O)O
InChI Key FQRQWPNYJOFDLO-UHFFFAOYSA-N
Molecular Formula C9H10O4
Exact Mass 182.173 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/FQRQWPNYJOFDLO-UHFFFAOYSA-N/IR
License URL
Source https://www.chemotion-repository.net/inchikey/FQRQWPNYJOFDLO-UHFFFAOYSA-N/IR
Version
Author Stefan Bräse
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T01:18:32.137076
MetadataModified 2024-09-07T15:24:58.092537
MetadataPublished 2019-06-27
Field Value
Measurement Technique infrared absorption spectroscopy
Measurement Variables