| SpectraBase Spectrum ID |
BztFRIDv2x6 |
| Name |
ethyl 2-benzoyl-4-cycloheptyl-3-(4-methoxyphenyl)butanoate |
| Appearance |
Pale yellow oily liquid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H34O4 |
| InChI |
InChI=1S/C27H34O4/c1-3-31-27(29)25(26(28)22-13-9-6-10-14-22)24(19-20-11-7-4-5-8-12-20)21-15-17-23(30-2)18-16-21/h6,9-10,13-18,20,24-25H,3-5,7-8,11-12,19H2,1-2H3 |
| InChIKey |
QTAGHHMXTVRFFD-UHFFFAOYSA-N |
| Instrument Name |
GCMS |
| Ionization Type |
EI |
| Molecular Weight |
422.565 g/mol |
| Reported Formula |
C27H35O4 |
| SMILES |
C(CC1CCCCCC1)(C(C(=O)c1ccccc1)C(=O)OCC)c1ccc(cc1)OC |
| SPLASH |
splash10-00di-0901100000-af7bb8311ab19f5888a1 |
| Sample Comments |
dr = 1.1:1 |
| Source of Spectrum |
CN108640839A |
| Wiley ID |
1872454 |
