Dataset

infrared absorption spectroscopy (IR)

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

Chemical Info

molecular Image
InChI InChI=1S/C11H12ClNO2/c1-14-4-5-15-8-2-3-9-10(12)7-13-11(9)6-8/h2-3,6-7,13H,4-5H2,1H3
SMILES COCCOc1ccc2c(c1)[nH]cc2Cl
InChI Key ABNQQHIZTDQAJQ-UHFFFAOYSA-N
Molecular Formula C11H12ClNO2
Exact Mass 225.671 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/ABNQQHIZTDQAJQ-UHFFFAOYSA-N/CHMO0000630
License URL
Source https://www.chemotion-repository.net/inchikey/ABNQQHIZTDQAJQ-UHFFFAOYSA-N/CHMO0000630
Version
Author Niklas Krappel
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T01:20:18.944513
MetadataModified 2024-09-08T01:20:18.944519
MetadataPublished 2023-07-31
Field Value
Measurement Technique infrared absorption spectroscopy
Measurement Variables