Dataset

high-resolution mass spectrometry (HRMS)

dataset for high-resolution mass spectrometry (HRMS)

Chemical Information

molecular Image
InChI InChI=1S/C24H39N3O6/c1-22(2,3)10-31-19(28)13-16(25)14(20(29)32-11-23(4,5)6)18(27)15(17(13)26)21(30)33-12-24(7,8)9/h10-12,25-27H2,1-9H3
SMILES O=C(c1c(N)c(C(=O)OCC(C)(C)C)c(c(c1N)C(=O)OCC(C)(C)C)N)OCC(C)(C)C
InChI Key GSTZJTYYYMCAPJ-UHFFFAOYSA-N
Molecular Formula C24H39N3O6
Exact Mass 465.583 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/GSTZJTYYYMCAPJ-UHFFFAOYSA-N/CHMO0000498
License URL
Source https://www.chemotion-repository.net/inchikey/GSTZJTYYYMCAPJ-UHFFFAOYSA-N/CHMO0000498
Version
Author Lisa Schmidt
Maintainer Chemotion Repository
Language english
MetadataPublished 2022-06-23
Related Molecule
  • tris(2,2-dimethylpropyl) 2,4,6-triaminobenzene-1,3,5-tricarboxylate
    • Field Value
    Measurement Technique high-resolution mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    163407576 PubChem
    The data in this table is sourced from UniChem at EBI.