| SpectraBase Spectrum ID |
8U0kYrPq4T8 |
| Name |
Methyl 7-[(4-methoxyphenyl)ethynyl]-2-methyl-1H-indole-6-carboxylate |
| Appearance |
Pale yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H17NO3 |
| InChI |
InChI=1S/C20H17NO3/c1-13-12-15-7-11-18(20(22)24-3)17(19(15)21-13)10-6-14-4-8-16(23-2)9-5-14/h4-5,7-9,11-12,21H,1-3H3 |
| InChIKey |
NLEFXXUSRNIRSG-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 |
319.360 g/mol |
| Reported Formula |
C20H17NO3 |
| SMILES |
[nH]1c(cc2c1c(c(cc2)C(OC)=O)C#Cc1ccc(cc1)OC)C |
| SPLASH |
splash10-000i-4913000000-2c065081cbdef0f06525 |
| Source of Spectrum |
BJO-8-SM20-4{n,c} |
| Thin-Layer Chromatography |
Rf = 0.33 (cyclohexane/ethyl acetate, 3:1) |
| Wiley ID |
1864933 |
![Methyl 7-[(4-methoxyphenyl)ethynyl]-2-methyl-1H-indole-6-carboxylate](/api/spectrum/8U0kYrPq4T8/structure.png?h=300&w=458 "Methyl 7-[(4-methoxyphenyl)ethynyl]-2-methyl-1H-indole-6-carboxylate")
