| SpectraBase Spectrum ID |
5xEgOSquCvj |
| Name |
methyl 4-(4-methoxyphenyl)-2-methyl-4-(1-methyl-1H-indol-3-yl)butanoate |
| Appearance |
Light yellow oil |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H25NO3 |
| InChI |
InChI=1S/C22H25NO3/c1-15(22(24)26-4)13-19(16-9-11-17(25-3)12-10-16)20-14-23(2)21-8-6-5-7-18(20)21/h5-12,14-15,19H,13H2,1-4H3 |
| InChIKey |
GXHOVPQAJORSJB-UHFFFAOYSA-N |
| Instrument Name |
LRMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201511624 |
| Molecular Weight |
351.446 g/mol |
| Reported Formula |
C22H25NO3 |
| SMILES |
COC(C(CC(C1=CN(C2=C1C=CC=C2)C)C1=CC=C(C=C1)OC)C)=O |
| SPLASH |
splash10-0udi-0092000000-673a2af942d19c09e93d |
| Sample Comments |
dr = 1.8:1 |
| Source of Spectrum |
ACI-55-SM22-17 (DOI: 10.1002/anie.201511624) |
| Wiley ID |
1895428 |
