Dataset

Chloramphenicol; LC-ESI-ITFT; MS2; CE: 55; R=15000; [M-H]-

This MassBank record with Accession MSBNK-UFZ-UF407351 contains the MS2 mass spectrum of Chloramphenicol with the InChIkey WIIZWVCIJKGZOK-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C11H12Cl2N2O5/c12-10(13)11(18)14-8(5-16)9(17)6-1-3-7(4-2-6)15(19)20/h1-4,8-10,16-17H,5H2,(H,14,18)
SMILES OCC(NC(=O)C(Cl)Cl)C(O)C1=CC=C(C=C1)N(=O)=O
InChI Key WIIZWVCIJKGZOK-UHFFFAOYSA-N
Molecular Formula C11H12Cl2N2O5
Exact Mass 322.012 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UFZ-UF407351
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MetadataPublished 2017-01-05
Related Molecule
  • 2,2-dichloro-N-[1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]acetamide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    27677786 eMolecules
    729366 eMolecules
    298 PubChem
    80001827 NMRShiftDB
    PD003050 ProbesDrugs
    15988503 PubChem: Thomson Pharma
    579-51-1 ACToR
    56-75-7 ACToR
    LSM-5069 LINCS
    PA448927 PharmGKB
    MCULE-8814562235 Mcule
    SCHEMBL537158 SureChEMBL
    94390 ChEBI
    HMDB0251098 Human Metabolome Database
    CLMPCL CCDC
    CHEMBL414400 ChEMBL
    SAM002548963 NIH Clinical Collection
    The data in this table is sourced from UniChem at EBI.