Dataset

Boc-Asp(OBzl)-OH; LC-ESI-QTOF; MS2; 100 V

This MassBank record with Accession MSBNK-BAFG-CSL23111027791 contains the MS2 mass spectrum of Boc-Asp(OBzl)-OH with the InChIkey SOHLZANWVLCPHK-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C16H21NO6/c1-16(2,3)23-15(21)17-12(14(19)20)9-13(18)22-10-11-7-5-4-6-8-11/h4-8,12H,9-10H2,1-3H3,(H,17,21)(H,19,20)
SMILES CC(C)(C)OC(=O)NC(CC(=O)OCC1=CC=CC=C1)C(=O)O
InChI Key SOHLZANWVLCPHK-UHFFFAOYSA-N
Molecular Formula C16H21NO6
Exact Mass 323.137 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BAFG-CSL23111027791
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MetadataPublished 2023-11-10
Related Molecule
  • 2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxo-4-phenylmethoxybutanoic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    7536-58-5 ACToR
    SCHEMBL344670 SureChEMBL
    115815-47-9 ACToR
    2749517 eMolecules
    82036 PubChem
    MCULE-7302154819 Mcule
    CHEMBL1906597 ChEMBL
    The data in this table is sourced from UniChem at EBI.