Dataset

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

This MassBank record with Accession MSBNK-UoB-XB000300 contains the MS2 mass spectrum of Amitriptyline with the InChIkey KRMDCWKBEZIMAB-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C20H23N/c1-21(2)15-7-12-20-18-10-5-3-8-16(18)13-14-17-9-4-6-11-19(17)20/h3-6,8-12H,7,13-15H2,1-2H3
SMILES CN(C)CCC=C1C2=CC=CC=C2CCC3=CC=CC=C31
InChI Key KRMDCWKBEZIMAB-UHFFFAOYSA-N
Molecular Formula C20H23N
Exact Mass 277.183 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-XB000300
Version
Author
Maintainer
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MetadataPublished 2022-11-08
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