| SpectraBase Spectrum ID |
GsSasdsRjcE |
| Name |
Tryptamine |
| Acquisition Mode |
SIMULTANEOUS |
| CAS Registry Number |
343-94-2
34685-69-3
61-54-1 |
| ChEBI ID |
16765 |
| Comments |
saturated N/A Tryptamine - vendor: Sigma T-9511; Solvent: D2O; Buffers, etc: 50 mM Sodium Phosphate, 500 uM NaAzide; Temperature=298 K, pH=7.4; NMR Reference: 500 uM DSS; Bruker DMX 400MHz
(Data collected by Madison Metabolomics Consortium) |
| Copyright |
Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Data Source |
Madison Metabolomics Consortium |
| Formula |
C10H12N2 |
| IUPAC Name |
2-(1H-indol-3-yl)ethanamine |
| 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 |
| InChIKey |
APJYDQYYACXCRM-UHFFFAOYSA-N |
| KEGG Compound ID |
C00398 |
| KEGG Pathways |
PATH: map00380 Tryptophan metabolism
PATH: map00900 Terpenoid biosynthesis
PATH: map00901 Indole and ipecac alkaloid biosynthesis
PATH: map04080 Neuroactive ligand-receptor interaction |
| PubChem Compound ID |
1150 |
| SMILES |
C1=CC=C2C(=C1)C(=CN2)CCN |
| Source File Reference |
bmse000207 |
