Dataset

1H--1H correlation spectroscopy (1H-1H COSY)

dataset for 1H--1H correlation spectroscopy (1H-1H COSY)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C8H15Br/c1-2-3-4-5-6-7-8-9/h2H,1,3-8H2
SMILES BrCCCCCCC=C
InChI Key SNMOMUYLFLGQQS-UHFFFAOYSA-N
Molecular Formula C8H15Br
Exact Mass 191.109 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/SNMOMUYLFLGQQS-UHFFFAOYSA-N/CHMO0001150
License URL
Source https://www.chemotion-repository.net/inchikey/SNMOMUYLFLGQQS-UHFFFAOYSA-N/CHMO0001150
Version
Author Alex Johnson
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T04:28:21.645941
MetadataModified 2024-09-08T04:28:21.645946
MetadataPublished 2024-08-08
Field Value
Measurement Technique 1H–1H correlation spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
DTXSID30181437 EPA CompTox Dashboard
ZINC000001841092 ZINC
MolPort-001-791-963 MolPort
J192.202E Nikkaji
20208258 NMRShiftDB
SCHEMBL346392 SureChEMBL
2695-48-9 ACToR
75907 PubChem
CB3328813 ChemicalBook
15911539 PubChem: Thomson Pharma
485599 eMolecules
The data in this table is sourced from UniChem at EBI.