Dataset

N-ACETYL-ALANYL-VALYL-GLYCINE METHYL ESTER

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP000253 contains the MS mass spectrum of N-ACETYL-ALANYL-VALYL-GLYCINE METHYL ESTER with the InChIkey UEGJWOSKZCVBFS-GZMMTYOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C13H23N3O5/c1-7(2)11(13(20)14-6-10(18)21-5)16-12(19)8(3)15-9(4)17/h7-8,11H,6H2,1-5H3,(H,14,20)(H,15,17)(H,16,19)/t8-,11+/m0/s1
SMILES COC(=O)CNC(=O)C([H])(C(C)C)NC(=O)C([H])(C)NC(C)=O
InChI Key UEGJWOSKZCVBFS-GZMMTYOYSA-N
Molecular Formula C13H23N3O5
Exact Mass 301.164 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP000253
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T16:25:49.791126
MetadataModified 2025-02-09T12:36:09.307091
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
134769889 PubChem
The data in this table is sourced from UniChem at EBI.