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/C15H20N4/c1-11-9-10-12-7-6-8-13(14(12)16-11)17-15(18(2)3)19(4)5/h6-10H,1-5H3
SMILES Cc1ccc2c(n1)c(ccc2)N=C(N(C)C)N(C)C
InChI Key XNDIRRNFWBFJDQ-UHFFFAOYSA-N
Molecular Formula C15H20N4
Exact Mass 256.346 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/XNDIRRNFWBFJDQ-UHFFFAOYSA-N/CHMO0000763
License URL
Source https://www.chemotion-repository.net/inchikey/XNDIRRNFWBFJDQ-UHFFFAOYSA-N/CHMO0000763
Version
Author Alexander Hoffmann
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T06:17:58.164872
MetadataModified 2024-09-07T21:57:16.202647
MetadataPublished 2022-03-05
Field Value
Measurement Technique attenuated total reflectance Fourier transform infrared spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
101584847 PubChem
REJMUS CCDC
J3.078.259C Nikkaji
The data in this table is sourced from UniChem at EBI.