| SpectraBase Spectrum ID |
Ij8uvlN8yRG |
| Name |
Methyl 7-[4-(tert-butyl)phenyl]-3-methyl-1H-indole-6-carboxylate |
| Appearance |
Pale yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H23NO2 |
| InChI |
InChI=1S/C21H23NO2/c1-13-12-22-19-16(13)10-11-17(20(23)24-5)18(19)14-6-8-15(9-7-14)21(2,3)4/h6-12,22H,1-5H3 |
| InChIKey |
PRHOBNSZJCIYOD-UHFFFAOYSA-N |
| Instrument Name |
Kratos MS 50/Thermo Quest Finnigan MAT 95 XL |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.8.132 |
| Molecular Weight |
321.420 g/mol |
| Reported Formula |
C21H23NO2 |
| SMILES |
[nH]1cc(c2c1c(c(cc2)C(OC)=O)-c1ccc(cc1)C(C)(C)C)C |
| SPLASH |
splash10-00di-0009000000-bdac3d9ecc22ea11abf2 |
| Source of Spectrum |
BJO-8-SM18-4{l,b} |
| Thin-Layer Chromatography |
Rf = 0.65 (cyclohexane/ethyl acetate, 3:1) |
| Wiley ID |
1864925 |
![Methyl 7-[4-(tert-butyl)phenyl]-3-methyl-1H-indole-6-carboxylate](/api/spectrum/Ij8uvlN8yRG/structure.png?h=300&w=458 "Methyl 7-[4-(tert-butyl)phenyl]-3-methyl-1H-indole-6-carboxylate")
