Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C18H28N6/c1-13(2)24(14(3)4)22-21-18-17(10-19)11-20-23(18)12-16-8-6-15(5)7-9-16/h6-9,11,13-14H,10,12,19H2,1-5H3/b22-21+
SMILES NCc1cnn(c1/N=N/N(C(C)C)C(C)C)Cc1ccc(cc1)C
InChI Key KQBXWZPQDCVAGS-QURGRASLSA-N
Molecular Formula C18H28N6
Exact Mass 328.455 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/KQBXWZPQDCVAGS-QURGRASLSA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/KQBXWZPQDCVAGS-QURGRASLSA-N/CHMO0000593
Version
Author Nicolai Wippert
Maintainer Chemotion Repository
Language english
MetadataPublished 2021-09-10
Related Molecule
  • N-[(E)-[4-(aminomethyl)-2-[(4-methylphenyl)methyl]pyrazol-3-yl]diazenyl]-N-propan-2-ylpropan-2-amine
    • Field Value
    Measurement Technique 1H nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    155928539 PubChem
    The data in this table is sourced from UniChem at EBI.