Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C16H11N5/c1-2-6-12(7-3-1)15-11-21(20-19-15)16-10-17-13-8-4-5-9-14(13)18-16/h1-11H
SMILES c1ccc(cc1)c1nnn(c1)c1cnc2c(n1)cccc2
InChI Key QYOUUXWQIVRDNZ-UHFFFAOYSA-N
Molecular Formula C16H11N5
Exact Mass 273.292 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/QYOUUXWQIVRDNZ-UHFFFAOYSA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/QYOUUXWQIVRDNZ-UHFFFAOYSA-N/CHMO0000593
Version
Author Laura Holzhauer
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T06:10:26.218272
MetadataModified 2024-09-07T21:51:28.858466
MetadataPublished 2022-02-11
Field Value
Measurement Technique 1H nuclear magnetic resonance spectroscopy
Measurement Variables