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/C10H12O3/c1-7(11)9-6-8(12-2)4-5-10(9)13-3/h4-6H,1-3H3
SMILES COc1ccc(c(c1)C(=O)C)OC
InChI Key FAXUIYJKGGUCBO-UHFFFAOYSA-N
Molecular Formula C10H12O3
Exact Mass 180.200 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/FAXUIYJKGGUCBO-UHFFFAOYSA-N/CHMO0001150
License URL
Source https://www.chemotion-repository.net/inchikey/FAXUIYJKGGUCBO-UHFFFAOYSA-N/CHMO0001150
Version
Author Grace Hunt
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T04:25:46.275598
MetadataModified 2025-02-04T13:22:14.940414
MetadataPublished 2024-08-07
Field Value
Measurement Technique 1H–1H correlation spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
536871 eMolecules
SCHEMBL885028 SureChEMBL
15487269 PubChem: Thomson Pharma
1201-38-3 ACToR
CB5150014 ChemicalBook
Y79C66POM1 FDA SRS
J80.091K Nikkaji
ZINC000000164090 ZINC
DTXSID0061618 EPA CompTox Dashboard
MCULE-3800952212 Mcule
20143551 NMRShiftDB
70991 PubChem
The data in this table is sourced from UniChem at EBI.