| SpectraBase Spectrum ID |
FRC7K7vvPpU |
| Name |
diethyl 2-(2-(1,5-dimethyl-1H-indol-3-yl)-2-p-tolylethyl)-2-methylmalonate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
435.240958543 u |
| Formula |
C27H33NO4 |
| InChI |
InChI=1S/C27H33NO4/c1-7-31-25(29)27(5,26(30)32-8-2)16-22(20-12-9-18(3)10-13-20)23-17-28(6)24-14-11-19(4)15-21(23)24/h9-15,17,22H,7-8,16H2,1-6H3 |
| InChIKey |
CURCDOPOBPHIOW-UHFFFAOYSA-N |
| Instrument Name |
LRMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201511624 |
| Molecular Weight |
435.564 g/mol |
| Reported Formula |
C27H33NO4 |
| SMILES |
C(CC(C(OCC)=O)(C)C(OCC)=O)(C=1C2=C(N(C1)C)C=CC(=C2)C)C1=CC=C(C=C1)C |
| SPLASH |
splash10-01ot-0090000000-c2f68d16f3265f2338ba |
| Source of Spectrum |
ACI-55-SM34-39 (DOI: 10.1002/anie.201511624) |
| Wiley ID |
1895445 |
