SpectraBase Spectrum ID |
8FuN32YsIYC |
Name |
Indole-3-lactic acid |
CAS Registry Number |
832-97-3 |
Classification |
Chemical |
Comments |
Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
205.073893215 u |
Formula |
C11H11NO3 |
InChI |
InChI=1S/C11H11NO3/c13-10(11(14)15)5-7-6-12-9-4-2-1-3-8(7)9/h1-4,6,10,12-13H,5H2,(H,14,15) |
InChIKey |
XGILAAMKEQUXLS-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
205.213 g/mol |
Nominal Mass |
205 u |
Quality |
968 |
Retention Index |
1619 |
SMILES |
OC(C(CC=1C=2C(NC1)=CC=CC2)O)=O |
SPLASH |
splash10-001i-2920000000-d37143256460147f44b3 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
2-Hydroxy-3-(1H-indol-3-yl)propanoic acid |
Technique |
GC/MS |
Wiley ID |
DD2024_022582 |