Dataset

high-resolution electrospray ionisation mass spectrometry (HRESIMS)

dataset for high-resolution electrospray ionisation mass spectrometry (HRESIMS)

Chemical Information

molecular Image
InChI InChI=1S/C13H19N5O2/c1-13(2,3)20-12(19)14-10-11(17-8-4-6-15-17)18-9-5-7-16-18/h4-9,11H,10H2,1-3H3,(H,14,19)
SMILES O=C(OC(C)(C)C)NCC(n1cccn1)n1cccn1
InChI Key ZZFUHQXQLNLLCA-UHFFFAOYSA-N
Molecular Formula C13H19N5O2
Exact Mass 277.322 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/ZZFUHQXQLNLLCA-UHFFFAOYSA-N/CHMO0000485
License URL
Source https://www.chemotion-repository.net/inchikey/ZZFUHQXQLNLLCA-UHFFFAOYSA-N/CHMO0000485
Version
Author Sonja Herres-Pawlis
Maintainer Chemotion Repository
Language english
MetadataPublished 2021-04-28
Related Molecule
  • tert-butyl N-[2,2-di(pyrazol-1-yl)ethyl]carbamate
    • Field Value
    Measurement Technique high-resolution electrospray ionisation mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    155906997 PubChem
    The data in this table is sourced from UniChem at EBI.