Dataset

beta-3-Indolylethylamine hydrochloride, Tryptamine Hydrochloride, 3-(2-Aminoethyl)indole Hydrochloride

This MassBank record with Accession MSBNK-RIKEN_ReSpect-PS006902 contains the MS2 mass spectrum of beta-3-Indolylethylamine hydrochloride, Tryptamine Hydrochloride, 3-(2-Aminoethyl)indole Hydrochloride with the InChIkey APJYDQYYACXCRM-UHFFFAOYSA-N.

Chemical Info

InChI	InChI=1S/C10H12N2/c11-6-5-8-7-12-10-4-2-1-3-9(8)10/h1-4,7,12H,5-6,11H2
SMILES	C1=CC=C2C(=C1)C(=CN2)CCN
InChI Key	APJYDQYYACXCRM-UHFFFAOYSA-N
Molecular Formula	C10H12N2
Exact Mass	160.220 g/mol

Data and Resources

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Metadata Information

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by-nc/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN_ReSpect-PS006902
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T21:16:18.261754
MetadataModified	2025-02-09T19:16:52.607656
MetadataPublished	2009-02-09

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
CB8192006	ChemicalBook
HMDB0000303	Human Metabolome Database
63178	Brenda
MTBLC16765	Metabolights
363	Brenda
20143557	NMRShiftDB
MCULE-6402431765	Mcule
1150	PubChem
PD000807	ProbesDrugs
SCHEMBL26725	SureChEMBL
14891690	PubChem: Thomson Pharma
422ZU9N5TV	FDA SRS
487234	eMolecules
XUDTOF	CCDC
J4.816J	Nikkaji
50024210	BindingDB
HY-B2132	MedChemExpress
DTXSID2075340	EPA CompTox Dashboard
ZINC000000120144	ZINC
DB08653	DrugBank
C00398	KEGG Ligand
CHEMBL6640	ChEMBL
16765	ChEBI
TSS	PDBe
125	Guide to Pharmacology
The data in this table is sourced from UniChem at EBI.