| SpectraBase Spectrum ID |
3prvkyewls |
| Name |
ethyl 7-(4-bromophenyl)-7-(4-methoxyphenyl)heptanoate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
418.114357726 u |
| Formula |
C22H27BrO3 |
| InChI |
InChI=1S/C22H27BrO3/c1-3-26-22(24)8-6-4-5-7-21(17-9-13-19(23)14-10-17)18-11-15-20(25-2)16-12-18/h9-16,21H,3-8H2,1-2H3 |
| InChIKey |
AOYWQZFVPJFDLC-UHFFFAOYSA-N |
| Instrument Name |
FINNIGAN MAT 95Q |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202101682 |
| Molecular Weight |
419.359 g/mol |
| Quality |
15 |
| Reported Formula |
C22H27BrO3 |
| SMILES |
C=1(C(CCCCCC(OCC)=O)C=2C=CC(=CC2)OC)C=CC(=CC1)Br |
| SPLASH |
splash10-004i-0290000000-7f5ad3c04fada24ee886 |
| Source of Spectrum |
ACI-60-SM34-6h (DOI: 10.1002/anie.202101682) |
| Wiley ID |
1891278 |
