Dataset
distortionless enhancement with polarization transfer (DEPT)
Chemical Info
InChI | InChI=1S/C4H9ClO/c5-3-1-2-4-6/h6H,1-4H2 |
---|---|
SMILES | OCCCCCl |
InChI Key | HXHGULXINZUGJX-UHFFFAOYSA-N |
Exact Mass | 108.567 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.14272/HXHGULXINZUGJX-UHFFFAOYSA-N/CHMO0000596 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/HXHGULXINZUGJX-UHFFFAOYSA-N/CHMO0000596 |
Version | |
Author | Jana Barylko |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T04:21:19.549246 |
MetadataModified | 2024-09-23T09:25:48.916550 |
MetadataPublished | 2024-08-07 |
Field | Value |
---|---|
Measurement Technique | distortionless enhancement with polarization transfer |
Measurement Variables |
|
Data-Source Molecule ID | Data-Source |
---|---|
87310 | ChEBI |
91667 | Brenda |
MCULE-3507644812 | Mcule |
DTXSID2061301 | EPA CompTox Dashboard |
ZINC000001712476 | ZINC |
13569 | PubChem |
J35.120B | Nikkaji |
HMDB0246381 | Human Metabolome Database |
MolPort-001-757-740 | MolPort |
CHEMBL2260957 | ChEMBL |
SCHEMBL1041 | SureChEMBL |
490942 | eMolecules |
928-51-8 | ACToR |
42EI3I5AY0 | FDA SRS |
15194315 | PubChem: Thomson Pharma |
CB5100347 | ChemicalBook |
43431 | Brenda |
MTBLC87310 | Metabolights |
10016642 | NMRShiftDB |
The data in this table is sourced from UniChem at EBI. |