| SpectraBase Spectrum ID |
xzIJDU9ApL |
| Name |
4-(3-INDOLYL)-BUTYRIC ACID |
| CAS Registry Number |
133-32-4 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
203.094628661 u |
| Formula |
C12H13NO2 |
| InChI |
InChI=1S/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15) |
| InChIKey |
JTEDVYBZBROSJT-UHFFFAOYSA-N |
| Molecular Weight |
203.241 g/mol |
| Nominal Mass |
203 u |
| Number of Peaks |
66 |
| SMILES |
[nH]1c2c(c(CCCC(=O)O)c1)cccc2 |
| SPLASH |
splash10-001i-1910000000-478201c2fe376d495e98 |
| Source of Spectrum |
Dr. Rolf Kuehnle |
| Synonyms |
4-(1H-indol-3-yl)butanoic acid |
| Technique |
GC/MS |
| Wiley ID |
WID_MSPA_3497 |
