Dataset

N-Formyl-4-aminoantipyrine

This MassBank record with Accession MSBNK-UFZ-UF411354 contains the MS2 mass spectrum of N-Formyl-4-aminoantipyrine with the InChIkey WSJBSKRPKADYRQ-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C12H13N3O2/c1-9-11(13-8-16)12(17)15(14(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,13,16)
SMILES [H]C(=O)NC1=C(C)N(C)N(C1=O)C1=CC=CC=C1
InChI Key WSJBSKRPKADYRQ-UHFFFAOYSA-N
Molecular Formula C12H13N3O2
Exact Mass 231.101 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UFZ-UF411354
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:00:07.530257
MetadataModified 2025-02-09T19:48:28.390768
MetadataPublished 2017-01-05
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
1071371 eMolecules
1672-58-8 ACToR
15464481 PubChem: Thomson Pharma
SCHEMBL6812409 SureChEMBL
MTBLC83526 Metabolights
CB2876357 ChemicalBook
USOBUA CCDC
HY-133588 MedChemExpress
DTXSID10168241 EPA CompTox Dashboard
J61.595A Nikkaji
HMDB0246429 Human Metabolome Database
63DKU1M0XK FDA SRS
ZINC000000301550 ZINC
83526 ChEBI
72666 PubChem
MCULE-4865850721 Mcule
The data in this table is sourced from UniChem at EBI.