| SpectraBase Spectrum ID |
JOwqbQB7gBV |
| Name |
methyl 2-methyl-4-(1-methyl-1H-indol-3-yl)-4-p-tolylbutanoate |
| Appearance |
Light yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H25NO2 |
| InChI |
InChI=1S/C22H25NO2/c1-15-9-11-17(12-10-15)19(13-16(2)22(24)25-4)20-14-23(3)21-8-6-5-7-18(20)21/h5-12,14,16,19H,13H2,1-4H3 |
| InChIKey |
XLTCZJTYGTUNIP-UHFFFAOYSA-N |
| Instrument Name |
LRMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201511624 |
| Molecular Weight |
335.447 g/mol |
| Reported Formula |
C22H25NO2 |
| SMILES |
C(CC(C(=O)OC)C)(C1=CC=C(C=C1)C)C1=CN(C2=C1C=CC=C2)C |
| SPLASH |
splash10-001i-0093000000-fb19e8b5ffdd369cb186 |
| Sample Comments |
dr = 1.6:1 |
| Source of Spectrum |
ACI-55-SM13-4 (DOI: 10.1002/anie.201511624) |
| Wiley ID |
1895451 |
