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/C11H12O/c1-8-6-7-9-4-2-3-5-10(9)11(8)12/h2-5,8H,6-7H2,1H3
SMILES CC1CCc2c(C1=O)cccc2
InChI Key GANIBVZSZGNMNB-UHFFFAOYSA-N
Molecular Formula C11H12O
Exact Mass 160.212 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/GANIBVZSZGNMNB-UHFFFAOYSA-N/CHMO0001146
License URL
Source https://www.chemotion-repository.net/inchikey/GANIBVZSZGNMNB-UHFFFAOYSA-N/CHMO0001146
Version
Author Grace Hunt
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T04:29:36.910808
MetadataModified 2024-09-08T04:29:36.910813
MetadataPublished 2024-08-09
Field Value
Measurement Technique 1H–13C heteronuclear single quantum coherence
Measurement Variables
Data-Source Molecule ID Data-Source
SCHEMBL677613 SureChEMBL
15946815 PubChem: Thomson Pharma
1590-08-5 ACToR
CB7166826 ChemicalBook
MCULE-2306893485 Mcule
10023498 NMRShiftDB
156394 ChEBI
J130.713D Nikkaji
102650 PubChem
484540 eMolecules
The data in this table is sourced from UniChem at EBI.