| SpectraBase Spectrum ID |
Eqcc8Ifpr5d |
| Name |
Tert-butyl ester of (S)-2-[2-(4-bromophenyl)-5-methyl-1H-pyrrol-1-yl]propionic acid |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
363.083391950 u |
| Formula |
C18H22BrNO2 |
| InChI |
InChI=1S/C18H22BrNO2/c1-12-6-11-16(14-7-9-15(19)10-8-14)20(12)13(2)17(21)22-18(3,4)5/h6-11,13H,1-5H3/t13-/m0/s1 |
| InChIKey |
WKZSNCZHAPRZAT-ZDUSSCGKSA-N |
| Molecular Weight |
364.283 g/mol |
| SMILES |
C=1(N(C(=CC1)C)[C@](C(OC(C)(C)C)=O)(C)[H])C1=CC=C(C=C1)Br |
![Tert-butyl ester of (S)-2-[2-(4-bromophenyl)-5-methyl-1H-pyrrol-1-yl]propionic acid](/api/spectrum/Eqcc8Ifpr5d/structure.png?h=300&w=458 "Tert-butyl ester of (S)-2-[2-(4-bromophenyl)-5-methyl-1H-pyrrol-1-yl]propionic acid")
