Dataset

attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)

dataset for attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C13H14N2O2/c1-13(2,3)11-8-7-9-5-4-6-10(15(16)17)12(9)14-11/h4-8H,1-3H3
SMILES [O-][N+](=O)c1cccc2c1nc(cc2)C(C)(C)C
InChI Key YLBKXSDEWVMGQE-UHFFFAOYSA-N
Molecular Formula C13H14N2O2
Exact Mass 230.262 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/YLBKXSDEWVMGQE-UHFFFAOYSA-N/CHMO0000763
License URL
Source https://www.chemotion-repository.net/inchikey/YLBKXSDEWVMGQE-UHFFFAOYSA-N/CHMO0000763
Version
Author Alexander Hoffmann
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T06:14:22.235560
MetadataModified 2024-09-07T21:54:27.385589
MetadataPublished 2022-02-18
Field Value
Measurement Technique attenuated total reflectance Fourier transform infrared spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
3002899 PubChem
The data in this table is sourced from UniChem at EBI.