Dataset

1H--13C heteronuclear single quantum coherence (1H-13C HSQC)

dataset for 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C11H13BrO2/c1-6(2)10-8(5-13)11(14)7(3)4-9(10)12/h4-6,14H,1-3H3
SMILES O=Cc1c(O)c(C)cc(c1C(C)C)Br
InChI Key HKSXVOUAEWPBKY-UHFFFAOYSA-N
Molecular Formula C11H13BrO2
Exact Mass 257.124 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/HKSXVOUAEWPBKY-UHFFFAOYSA-N/CHMO0001146
License URL
Source https://www.chemotion-repository.net/inchikey/HKSXVOUAEWPBKY-UHFFFAOYSA-N/CHMO0001146
Version
Author Sylvia Vanderheiden-Schroen
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T05:25:28.887938
MetadataModified 2024-09-07T20:54:16.880818
MetadataPublished 2022-01-06
Field Value
Measurement Technique 1H–13C heteronuclear single quantum coherence
Measurement Variables
Data-Source Molecule ID Data-Source
49874601 PubChem
The data in this table is sourced from UniChem at EBI.