SpectraBase Spectrum ID |
Dm2mha3rMn2 |
Name |
5-Hydroxy-3-indoleacetic acid |
CAS Registry Number |
54-16-0 |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
191.058243151 u |
Formula |
C10H9NO3 |
InChI |
InChI=1S/C10H9NO3/c12-7-1-2-9-8(4-7)6(5-11-9)3-10(13)14/h1-2,4-5,11-12H,3H2,(H,13,14) |
InChIKey |
DUUGKQCEGZLZNO-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
191.186 g/mol |
Nominal Mass |
191 u |
Quality |
865 |
Retention Index |
1481 |
SMILES |
OC(CC1=CNC=2C1=CC(=CC2)O)=O |
SPLASH |
splash10-0002-3900000000-19e3ffa60f47b848e0e6 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
(5-hydroxy-1H-indol-3-yl)acetic acid |
Technique |
GC/MS |
Wiley ID |
DD2024_021608 |