Dataset

2,3-DIBROMO-1-PROPANOL

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP005837 contains the MS mass spectrum of 2,3-DIBROMO-1-PROPANOL with the InChIkey QWVCIORZLNBIIC-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C3H6Br2O/c4-1-3(5)2-6/h3,6H,1-2H2
SMILES OCC(Br)CBr
InChI Key QWVCIORZLNBIIC-UHFFFAOYSA-N
Molecular Formula C3H6Br2O
Exact Mass 215.879 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP005837
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T15:55:00.980144
MetadataModified 2024-01-11T15:55:01.128336
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CHEMBL1403428 ChEMBL
C19224 KEGG Ligand
537346 eMolecules
96-13-9 ACToR
116499-75-3 ACToR
7281 PubChem
14773477 PubChem: Thomson Pharma
J3.961F Nikkaji
10024478 NMRShiftDB
MCULE-9616107956 Mcule
SCHEMBL288971 SureChEMBL
CB7445143 ChemicalBook
124155 Brenda
DTXSID7021817 EPA CompTox Dashboard
C0YBW1OA2I FDA SRS
207250 Brenda
The data in this table is sourced from UniChem at EBI.