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/C47H58N6O2Si/c1-35-36(49-38-24-16-15-23-37(38)48-35)29-30-43-44(51-40-26-18-17-25-39(40)50-43)31-32-45-46(53-42-28-20-19-27-41(42)52-45)54-33-21-13-11-9-7-8-10-12-14-22-34-55-56(5,6)47(2,3)4/h15-20,23-32H,7-14,21-22,33-34H2,1-6H3/b30-29+,32-31+
SMILES Cc1nc2ccccc2nc1/C=C/c1nc2ccccc2nc1/C=C/c1nc2ccccc2nc1OCCCCCCCCCCCCO[Si](C(C)(C)C)(C)C
InChI Key JUTBIEGEKGNYJD-PNBBGTCESA-N
Molecular Formula C47H58N6O2Si
Exact Mass 767.088 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/JUTBIEGEKGNYJD-PNBBGTCESA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/JUTBIEGEKGNYJD-PNBBGTCESA-N/CHMO0000593
Version
Author Jérôme Klein
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T06:39:43.426409
MetadataModified 2024-09-07T22:14:48.733359
MetadataPublished 2022-04-17
Field Value
Measurement Technique 1H nuclear magnetic resonance spectroscopy
Measurement Variables