Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C36H28OP2.C12H11N2.Cu/c1-5-17-29(18-6-1)38(30-19-7-2-8-20-30)35-27-15-13-25-33(35)37-34-26-14-16-28-36(34)39(31-21-9-3-10-22-31)32-23-11-4-12-24-32;1-10-4-6-11(7-5-10)14-9-12-3-2-8-13-12;/h1-28H;2-9H,1H3;/q;-1;+1/b;14-9+;
SMILES c1ccc(cc1)P(c1ccccc1Oc1ccccc1P(c1ccccc1)c1ccccc1)c1ccccc1.Cc1ccc(cc1)/N=C/c1cccn1[Cu]
InChI Key QJQNAICAFONOJF-WNLPKAFNSA-N
Exact Mass 785.330 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/QJQNAICAFONOJF-WNLPKAFNSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/QJQNAICAFONOJF-WNLPKAFNSA-N/CHMO0000595
Version
Author Valentina Ferraro
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T03:17:27.050555
MetadataModified 2024-09-23T09:22:49.583596
MetadataPublished 2024-04-17
Field Value
Measurement Technique 13C nuclear magnetic resonance spectroscopy
Measurement Variables
Temperature : 298.0 K K

Puls programme : zgpg30

Number of scans : 1024

Title : Dec06-2022

Date : 20221207

Start time : 1.35 h

Instrument : Avance NEO

Label : VF-206

ID : 106410

Solvent : chloroform-D1 (CDCl3)

Data-Source Molecule ID Data-Source
No additional information available for this Dataset.