| SpectraBase Spectrum ID |
2AuDJQk3JJi |
| Name |
phenyl 4-(2-methoxyphenyl)-2-methyl-4-(1-methyl-1H-indol-3-yl)butanoate |
| Appearance |
Light yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
413.199093730 u |
| Formula |
C27H27NO3 |
| InChI |
InChI=1S/C27H27NO3/c1-19(27(29)31-20-11-5-4-6-12-20)17-23(22-14-8-10-16-26(22)30-3)24-18-28(2)25-15-9-7-13-21(24)25/h4-16,18-19,23H,17H2,1-3H3 |
| InChIKey |
KZXABWGPZVYKIG-UHFFFAOYSA-N |
| Instrument Name |
LRMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201511624 |
| Molecular Weight |
413.517 g/mol |
| Reported Formula |
C27H27NO3 |
| SMILES |
C1(=CC=CC=C1)OC(C(CC(C1=CN(C2=C1C=CC=C2)C)C1=C(C=CC=C1)OC)C)=O |
| SPLASH |
splash10-0udi-0091400000-d29c51f808a8aeadcc8c |
| Sample Comments |
dr = 1.5:1 |
| Source of Spectrum |
ACI-55-SM18-11 (DOI: 10.1002/anie.201511624) |
| Wiley ID |
1895420 |
