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/C14H24N4.C2H3N.ClHO4.Cu/c1-16(2)11-12-9-7-8-10-13(12)15-14(17(3)4)18(5)6;1-2-3;2-1(3,4)5;/h7-10H,11H2,1-6H3;1H3;(H,2,3,4,5);/q;;;+1/p-1
SMILES O=[Cl-](=O)(=O)=O.CN(Cc1ccccc1N=C(N(C)C)N(C)C)C.CC#N.[Cu+]
InChI Key SQELSYLGCLCOLU-UHFFFAOYSA-M
Molecular Formula C16H27ClCuN5O4
Exact Mass 452.416 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/SQELSYLGCLCOLU-UHFFFAOYSA-M/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/SQELSYLGCLCOLU-UHFFFAOYSA-M/CHMO0000593
Version
Author Sonja Herres-Pawlis
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T02:40:45.984381
MetadataModified 2024-09-07T17:18:13.614300
MetadataPublished 2020-02-28
Field Value
Measurement Technique 1H nuclear magnetic resonance spectroscopy
Measurement Variables