Dataset

Nialamide

This MassBank record with Accession MSBNK-Waters-WA002045 contains the MS mass spectrum of Nialamide with the InChIkey NOIIUHRQUVNIDD-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C16H18N4O2/c21-15(18-12-13-4-2-1-3-5-13)8-11-19-20-16(22)14-6-9-17-10-7-14/h1-7,9-10,19H,8,11-12H2,(H,18,21)(H,20,22)
SMILES O=C(CCNNC(=O)c(c2)ccnc2)NCc(c1)cccc1
InChI Key NOIIUHRQUVNIDD-UHFFFAOYSA-N
Molecular Formula C16H18N4O2
Exact Mass 298.143 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA002045
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:48:25.913889
MetadataModified 2024-01-11T22:48:26.105781
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
MolPort-001-783-584 MolPort
MCULE-7326088210 Mcule
HMDB0255576 Human Metabolome Database
J2.302G Nikkaji
ZINC000001713761 ZINC
HY-B1199 MedChemExpress
DTXSID1023362 EPA CompTox Dashboard
NIALAMIDE rxnorm
163693 BindingDB
1907 DrugCentral
94510 ChEBI
SAM001246861 NIH Clinical Collection
CHEMBL1256841 ChEMBL
DB04820 DrugBank
27678417 eMolecules
492142 eMolecules
SCHEMBL49430 SureChEMBL
T2Q0RYM725 FDA SRS
14751634 PubChem: Thomson Pharma
4472 PubChem
PD000240 ProbesDrugs
51-12-7 ACToR
LSM-5300 LINCS
The data in this table is sourced from UniChem at EBI.