Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Info

InChI	InChI=1S/C15H9BrINO/c16-14-11-5-2-1-4-10(11)7-8-13(14)19-15-12(17)6-3-9-18-15/h1-9H
SMILES	Ic1cccnc1Oc1ccc2c(c1Br)cccc2
InChI Key	HEJRWAHGCHPOOZ-UHFFFAOYSA-N
Molecular Formula	C15H9BrINO
Exact Mass	426.047 g/mol

Data and Resources

• 13C nuclear magnetic resonance spectroscopy (13C NMR)HTML
  Explore

  • More information
  • Go to resource

• 13c-nuclear-magneti...

Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/HEJRWAHGCHPOOZ-UHFFFAOYSA-N/CHMO0000595
License URL
Source	https://www.chemotion-repository.net/inchikey/HEJRWAHGCHPOOZ-UHFFFAOYSA-N/CHMO0000595
Version
Author	Simone Gräßle
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2025-01-29T10:15:40.763251
MetadataModified	2025-01-29T16:08:47.868480
MetadataPublished	2024-10-16

Field	Value
Measurement Technique	13C nuclear magnetic resonance spectroscopy
Measurement Variables	Temperature : 300.0 K K Puls programme : zgpg30 Number of scans : 1024 Title : SG-V4304 Waschen Date : 20240828 Start time : 14.52 h Instrument : spect Label : SG-3812 ID : 321910 Solvent : DMSO

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