Dataset

METHYLGUANIDINE

This MassBank record with Accession MSBNK-Antwerp_Univ-METOX_P102001_EF88 contains the MS2 mass spectrum of METHYLGUANIDINE with the InChIkey CHJJGSNFBQVOTG-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C2H7N3/c1-5-2(3)4/h1H3,(H4,3,4,5)
SMILES CNC(N)=N
InChI Key CHJJGSNFBQVOTG-UHFFFAOYSA-N
Molecular Formula C2H7N3
Exact Mass 73.064 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-METOX_P102001_EF88
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:31:58.171248
MetadataModified 2024-01-11T09:31:58.319618
MetadataPublished 2021-12-14
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
HMDB0001522 Human Metabolome Database
7235 Brenda
MTBLC16628 Metabolights
ZINC000004658576 ZINC
DTXSID4020872 EPA CompTox Dashboard
MCULE-7854448694 Mcule
5L0H5Q9VAG FDA SRS
14915913 PubChem: Thomson Pharma
60023784 NMRShiftDB
471-29-4 ACToR
10111 PubChem
PD098873 ProbesDrugs
SCHEMBL181641 SureChEMBL
J403K Nikkaji
C02294 KEGG Ligand
16628 ChEBI
MGX PDBe
36378874 eMolecules
The data in this table is sourced from UniChem at EBI.