Dataset

1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)

dataset for 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C9H10O2/c1-6-3-4-7(2)9(11)8(6)5-10/h3-5,11H,1-2H3
SMILES O=Cc1c(C)ccc(c1O)C
InChI Key WTHUWXPBPNTSHJ-UHFFFAOYSA-N
Molecular Formula C9H10O2
Exact Mass 150.175 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/WTHUWXPBPNTSHJ-UHFFFAOYSA-N/CHMO0001148
License URL
Source https://www.chemotion-repository.net/inchikey/WTHUWXPBPNTSHJ-UHFFFAOYSA-N/CHMO0001148
Version
Author Sylvia Vanderheiden-Schroen
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T05:25:38.876420
MetadataModified 2024-09-07T20:54:29.445399
MetadataPublished 2022-01-06
Field Value
Measurement Technique 1H–13C heteronuclear multiple bond coherence
Measurement Variables
Data-Source Molecule ID Data-Source
16154095 PubChem: Thomson Pharma
SCHEMBL3966986 SureChEMBL
978395 eMolecules
CB41010273 ChemicalBook
J1.259.680D Nikkaji
819297 PubChem
DTXSID10356060 EPA CompTox Dashboard
ZINC000000334847 ZINC
The data in this table is sourced from UniChem at EBI.