Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C62H44N4O2/c67-61-48-35-45(63-52-19-7-1-13-39(52)25-26-40-14-2-8-20-53(40)63)31-33-58(48)66-59-34-32-46(64-54-21-9-3-15-41(54)27-28-42-16-4-10-22-55(42)64)36-49(59)62(68)51-38-47(37-50(61)60(51)66)65-56-23-11-5-17-43(56)29-30-44-18-6-12-24-57(44)65/h1-24,31-38H,25-30H2
SMILES O=c1c2cc(ccc2n2c3c1cc(cc3c(=O)c1c2ccc(c1)N1c2ccccc2CCc2c1cccc2)N1c2ccccc2CCc2c1cccc2)N1c2ccccc2CCc2c1cccc2
InChI Key FCRXEDDTFRNVBW-UHFFFAOYSA-N
Exact Mass 877.038 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/FCRXEDDTFRNVBW-UHFFFAOYSA-N/CHMO0000593.1
License URL
Source https://www.chemotion-repository.net/inchikey/FCRXEDDTFRNVBW-UHFFFAOYSA-N/CHMO0000593.1
Version
Author Janine Haug
Maintainer Chemotion Repository
Language english
MetadataPublished 2026-01-16
Related Molecule
  • nfdi4chem-mol4463 (Unknown Molecule)
    • Field Value
    Measurement Technique 1H nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.