Dataset

Ramipril; LC-ESI-FT; MS2; CE: 20,40,130%; R=30000; [M+H]+

This MassBank record with Accession MSBNK-UoB-XB000600 contains the MS2 mass spectrum of Ramipril with the InChIkey HDACQVRGBOVJII-JBDAPHQKSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C23H32N2O5/c1-3-30-23(29)18(13-12-16-8-5-4-6-9-16)24-15(2)21(26)25-19-11-7-10-17(19)14-20(25)22(27)28/h4-6,8-9,15,17-20,24H,3,7,10-14H2,1-2H3,(H,27,28)/t15-,17-,18-,19-,20-/m0/s1
SMILES CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N2[C@H]3CCC[C@H]3C[C@H]2C(=O)O
InChI Key HDACQVRGBOVJII-JBDAPHQKSA-N
Molecular Formula C23H32N2O5
Exact Mass 416.231 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-UoB-XB000600
Version
Author
Maintainer
Language
MetadataPublished 2022-11-08
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  • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
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    CHEMBL1168 chembl
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    5362129 pubchem
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    Molport-001-736-571 molport
    2356 drugcentral
    50084681 bindingdb
    The data in this table is sourced from UniChem at EBI.