Dataset

infrared absorption spectroscopy (IR)

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

Chemical Info

molecular Image
InChI InChI=1S/C15H18O3/c1-6-11-7-12-10(4)13(17-5)8(2)9(3)14(12)18-15(11)16/h7H,6H2,1-5H3
SMILES CCc1cc2c(C)c(OC)c(c(c2oc1=O)C)C
InChI Key QROGAFPZULQEKR-UHFFFAOYSA-N
Molecular Formula C15H18O3
Exact Mass 246.302 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/QROGAFPZULQEKR-UHFFFAOYSA-N/IR
License URL
Source https://www.chemotion-repository.net/inchikey/QROGAFPZULQEKR-UHFFFAOYSA-N/IR
Version
Author Stefan Bräse
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T01:26:25.193165
MetadataModified 2024-09-07T15:36:46.660211
MetadataPublished 2019-06-27
Field Value
Measurement Technique infrared absorption spectroscopy
Measurement Variables