Dataset

5-Aminoindole; LC-ESI-QQ; MS2; CE:50 V; [M+H]+

This MassBank record with Accession MSBNK-Keio_Univ-KO002102 contains the MS2 mass spectrum of 5-Aminoindole with the InChIkey ZCBIFHNDZBSCEP-UHFFFAOYSA-N.

Chemical Info

molecular Image
Synonyms
1H-indol-5-amine
5-Aminoindole
Indol-5-ylamine
InChI InChI=1S/C8H8N2/c9-7-1-2-8-6(5-7)3-4-10-8/h1-5,10H,9H2
SMILES C1=CC2=C(C=CN2)C=C1N
InChI Key ZCBIFHNDZBSCEP-UHFFFAOYSA-N
Molecular Formula C8H8N2
Exact Mass 132.069 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Keio_Univ-KO002102
Version
Author
Maintainer
Language english
MetadataCreated 2024-01-11T17:29:02.230933
MetadataModified 2024-01-22T12:42:45.755371
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CHEMBL325916 ChEMBL
33067 ChEBI
476901 eMolecules
MCULE-5140857191 Mcule
136185 Brenda
CB1123588 ChemicalBook
ZINC000000153906 ZINC
DTXSID5063734 EPA CompTox Dashboard
32210 BindingDB
78867 PubChem
15437208 PubChem: Thomson Pharma
SCHEMBL130519 SureChEMBL
Q732PG0Y16 FDA SRS
HMDB0246749 Human Metabolome Database
TUPBUE CCDC
J80.971C Nikkaji
20200175 NMRShiftDB
The data in this table is sourced from UniChem at EBI.