| SpectraBase Spectrum ID |
3hCkuMCCSoX |
| Name |
ethyl 2-benzoyl-3-(4-bromophenyl)-4-cyclohexyl-butanoate |
| Appearance |
Pale yellow oily liquid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H29BrO3 |
| InChI |
InChI=1S/C25H29BrO3/c1-2-29-25(28)23(24(27)20-11-7-4-8-12-20)22(17-18-9-5-3-6-10-18)19-13-15-21(26)16-14-19/h4,7-8,11-16,18,22-23H,2-3,5-6,9-10,17H2,1H3 |
| InChIKey |
CXBMRCSZGOSMEJ-UHFFFAOYSA-N |
| Instrument Name |
GCMS |
| Ionization Type |
EI |
| Molecular Weight |
457.408 g/mol |
| Reported Formula |
C25H3079BrO3 |
| SMILES |
C(CC1CCCCC1)(C(C(=O)c1ccccc1)C(=O)OCC)c1ccc(cc1)Br |
| SPLASH |
splash10-0a4i-0901000000-27d8cb2f4ddc6a9ae3b9 |
| Sample Comments |
dr = 1.1:1 |
| Source of Spectrum |
CN108640839A |
| Wiley ID |
1872471 |
