Dataset

high-resolution mass spectrometry (HRMS)

dataset for high-resolution mass spectrometry (HRMS)

Chemical Information

molecular Image
InChI InChI=1S/C15H21N3O6/c1-4-22-13(19)7-10(16)8(14(20)23-5-2)12(18)9(11(7)17)15(21)24-6-3/h4-6,16-18H2,1-3H3
SMILES CCOC(=O)c1c(N)c(C(=O)OCC)c(c(c1N)C(=O)OCC)N
InChI Key HCVSNXJKNAAQBQ-UHFFFAOYSA-N
Molecular Formula C15H21N3O6
Exact Mass 339.344 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/HCVSNXJKNAAQBQ-UHFFFAOYSA-N/CHMO0000498
License URL
Source https://www.chemotion-repository.net/inchikey/HCVSNXJKNAAQBQ-UHFFFAOYSA-N/CHMO0000498
Version
Author Lisa Schmidt
Maintainer Chemotion Repository
Language english
MetadataPublished 2022-06-23
Related Molecule
  • triethyl 2,4,6-triaminobenzene-1,3,5-tricarboxylate
    • Field Value
    Measurement Technique high-resolution mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    163407581 PubChem
    The data in this table is sourced from UniChem at EBI.