| SpectraBase Spectrum ID |
Do4OMAiewkq |
| Name |
3-Indoleacrylicacid,methyl ester |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
201.078978596 u |
| Formula |
C12H11NO2 |
| InChI |
InChI=1S/C12H11NO2/c1-15-12(14)7-6-9-8-13-11-5-3-2-4-10(9)11/h2-8,13H,1H3/b7-6+ |
| InChIKey |
JKVXFZPEUCTHQO-VOTSOKGWSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
201.225 g/mol |
| Nominal Mass |
201 u |
| Quality |
856 |
| Retention Index |
1560 |
| SMILES |
C=12C(NC=C2\C=C\C(OC)=O)=CC=CC1 |
| SPLASH |
splash10-0fk9-3920000000-36d0be3482b82a76b793 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
3-(1H-Indol-3-yl)prop-2-enoic acid |
| Technique |
GC/MS |
| Wiley ID |
DD2024_031715 |
