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/C10H22O2/c11-9-7-5-3-1-2-4-6-8-10-12/h11-12H,1-10H2
SMILES OCCCCCCCCCCO
InChI Key FOTKYAAJKYLFFN-UHFFFAOYSA-N
Molecular Formula C10H22O2
Exact Mass 174.280 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/FOTKYAAJKYLFFN-UHFFFAOYSA-N/CHMO0001148
License URL
Source https://www.chemotion-repository.net/inchikey/FOTKYAAJKYLFFN-UHFFFAOYSA-N/CHMO0001148
Version
Author Jana Barylko
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T04:22:17.755640
MetadataModified 2024-09-08T04:22:17.755645
MetadataPublished 2024-08-07
Field Value
Measurement Technique 1H–13C heteronuclear multiple bond coherence
Measurement Variables
Data-Source Molecule ID Data-Source
496536 eMolecules
37153 PubChem
14772637 PubChem: Thomson Pharma
112-47-0 ACToR
5I577UDK52 FDA SRS
J10.105B Nikkaji
SCHEMBL27054 SureChEMBL
DTXSID3059420 EPA CompTox Dashboard
MCULE-3187467810 Mcule
WESTIX CCDC
1,10-DECANEDIOL rxnorm
ZINC000001758367 ZINC
48391 Brenda
CB5417700 ChemicalBook
The data in this table is sourced from UniChem at EBI.