Dataset

Tetracycline; LC-ESI-ITFT; MS2; CE: 105%; R=15000; [M+H]+

This MassBank record with Accession MSBNK-HBM4EU-HB001944 contains the MS2 mass spectrum of Tetracycline with the InChIkey OFVLGDICTFRJMM-WESIUVDSSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25,27-28,31-32H,7H2,1-3H3,(H2,23,30)/t9-,10-,15-,21+,22-/m0/s1
SMILES [H][C@@]12C[C@@]3([H])C(=C(O)[C@]1(O)C(=O)C(C(N)=O)=C(O)[C@H]2N(C)C)C(=O)C1=C(C=CC=C1O)[C@@]3(C)O
InChI Key OFVLGDICTFRJMM-WESIUVDSSA-N
Molecular Formula C22H24N2O8
Exact Mass 444.153 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-HBM4EU-HB001944
Version
Author
Maintainer
Language
MetadataPublished 2018-09-08
Related Molecule
  • nfdi4chem-mol47475(Unknown Molecule)
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.