Dataset

1H--1H correlation spectroscopy (1H-1H COSY)

dataset for 1H--1H correlation spectroscopy (1H-1H COSY)

Chemical Information

molecular Image
InChI InChI=1S/C16H17N5O/c22-16(12-6-2-1-3-7-12)21-11-13-10-20(14-8-4-5-9-14)18-15(13)17-19-21/h1-3,6-7,10,14H,4-5,8-9,11H2
SMILES O=C(c1ccccc1)N1N=Nc2c(C1)cn(n2)C1CCCC1
InChI Key JUJUWEBLNYJZJO-UHFFFAOYSA-N
Molecular Formula C16H17N5O
Exact Mass 295.339 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/JUJUWEBLNYJZJO-UHFFFAOYSA-N/CHMO0001150
License URL
Source https://www.chemotion-repository.net/inchikey/JUJUWEBLNYJZJO-UHFFFAOYSA-N/CHMO0001150
Version
Author Nicolai Wippert
Maintainer Chemotion Repository
Language english
MetadataPublished 2021-07-11
Related Molecule
  • (6-cyclopentyl-4H-pyrazolo[3,4-d]triazin-3-yl)-phenylmethanone
    • Field Value
    Measurement Technique 1H–1H correlation spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    155928546 PubChem
    The data in this table is sourced from UniChem at EBI.