| SpectraBase Spectrum ID |
BtagZ2b8KcP |
| Name |
Methyl 2,7-dimethyl-1H-indole-6-carboxylate |
| Appearance |
Pale yellow solid |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H13NO2 |
| InChI |
InChI=1S/C12H13NO2/c1-7-6-9-4-5-10(12(14)15-3)8(2)11(9)13-7/h4-6,13H,1-3H3 |
| InChIKey |
KYZGKGZHHFZVMS-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 |
203.241 g/mol |
| Reported Formula |
C12H13NO2 |
| SMILES |
[nH]1c(cc2ccc(c(c12)C)C(OC)=O)C |
| SPLASH |
splash10-0pi3-4940000000-74cfdffd665ecb02c3a1 |
| Source of Spectrum |
BJO-8-SM12-4{b,c} |
| Thin-Layer Chromatography |
Rf = 0.52 (cyclohexane/ethyl acetate, 3:1) |
| Wiley ID |
1864911 |
