Dataset

infrared absorption spectroscopy (IR)

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

Chemical Info

molecular Image
InChI InChI=1S/C17H23NO/c1-5-6-11-18-12-14(16(19)17(2,3)4)13-9-7-8-10-15(13)18/h7-10,12H,5-6,11H2,1-4H3
SMILES CCCCn1cc(c2c1cccc2)C(=O)C(C)(C)C
InChI Key HYKAEHNQLIFFFX-UHFFFAOYSA-N
Molecular Formula C17H23NO
Exact Mass 257.371 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/HYKAEHNQLIFFFX-UHFFFAOYSA-N/IR
License URL
Source https://www.chemotion-repository.net/inchikey/HYKAEHNQLIFFFX-UHFFFAOYSA-N/IR
Version
Author Yu-Chieh Huang
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T01:18:22.853673
MetadataModified 2024-09-07T15:24:43.791128
MetadataPublished 2019-06-27
Field Value
Measurement Technique infrared absorption spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
138453548 PubChem
The data in this table is sourced from UniChem at EBI.