| SpectraBase Spectrum ID |
EswxPpA877D |
| Name |
phenyl 4-(4-chlorophenyl)-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 |
417.149556715 u |
| Formula |
C26H24ClNO2 |
| InChI |
InChI=1S/C26H24ClNO2/c1-18(26(29)30-21-8-4-3-5-9-21)16-23(19-12-14-20(27)15-13-19)24-17-28(2)25-11-7-6-10-22(24)25/h3-15,17-18,23H,16H2,1-2H3 |
| InChIKey |
QJBJCDDJWKAFPT-UHFFFAOYSA-N |
| Instrument Name |
LRMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201511624 |
| Molecular Weight |
417.936 g/mol |
| Reported Formula |
C26H24(35)ClNO2 |
| SMILES |
C1(=CC=CC=C1)OC(C(CC(C1=CN(C2=C1C=CC=C2)C)C1=CC=C(C=C1)Cl)C)=O |
| SPLASH |
splash10-0udi-0092300000-1532f2db1ea3105fc851 |
| Sample Comments |
dr = 1:1 |
| Source of Spectrum |
ACI-55-SM16-7 (DOI: 10.1002/anie.201511624) |
| Wiley ID |
1895456 |
