Dataset

Ioperamide; LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+

This MassBank record with Accession MSBNK-CASMI_2016-SM848903 contains the MS2 mass spectrum of Ioperamide with the InChIkey RDOIQAHITMMDAJ-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C29H33ClN2O2/c1-31(2)27(33)29(24-9-5-3-6-10-24,25-11-7-4-8-12-25)19-22-32-20-17-28(34,18-21-32)23-13-15-26(30)16-14-23/h3-16,34H,17-22H2,1-2H3
SMILES CN(C)C(=O)C(CCN1CCC(O)(CC1)c1ccc(Cl)cc1)(c1ccccc1)c1ccccc1
InChI Key RDOIQAHITMMDAJ-UHFFFAOYSA-N
Molecular Formula C29H33ClN2O2
Exact Mass 476.223 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-CASMI_2016-SM848903
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MetadataPublished 2016-12-12
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    Measurement Technique liquid chromatography-mass spectrometry
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    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.