| SpectraBase Spectrum ID |
5EP5MMN1t2 |
| Name |
1-Acetyl-1H-Indole-3-aceticacid methyl ester |
| CAS Registry Number |
55191-22-5 |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
231.089543280 u |
| Formula |
C13H13NO3 |
| InChI |
InChI=1S/C13H13NO3/c1-9(15)14-8-10(7-13(16)17-2)11-5-3-4-6-12(11)14/h3-6,8H,7H2,1-2H3 |
| InChIKey |
SRIBLLYYOKTWMS-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
231.251 g/mol |
| Nominal Mass |
231 u |
| Quality |
993 |
| Retention Index |
1915 |
| SMILES |
C=12C(C(=CN2C(=O)C)CC(OC)=O)=CC=CC1 |
| SPLASH |
splash10-001i-2910000000-1facdb90b22143ee470f |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
methyl (1-acetyl-1H-indol-3-yl)acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_007609 |
