| SpectraBase Spectrum ID |
1aW07c8Ykkw |
| Name |
[1,1'-Biphenyl]-3-carboxylic acid, 4'-(acetyloxy)-, 2-(4-bromophenyl)-2-oxoethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
452.025936642 u |
| Formula |
C23H17BrO5 |
| InChI |
InChI=1S/C23H17BrO5/c1-15(25)29-21-11-7-16(8-12-21)18-3-2-4-19(13-18)23(27)28-14-22(26)17-5-9-20(24)10-6-17/h2-13H,14H2,1H3 |
| InChIKey |
JFFOFWQSMRHQNO-UHFFFAOYSA-N |
| Molecular Weight |
453.288 g/mol |
| SMILES |
C(C=1C=C(C=2C=CC(OC(=O)C)=CC2)C=CC1)(OCC(C1=CC=C(C=C1)Br)=O)=O |
![[1,1'-Biphenyl]-3-carboxylic acid, 4'-(acetyloxy)-, 2-(4-bromophenyl)-2-oxoethyl ester](/api/spectrum/1aW07c8Ykkw/structure.png?h=300&w=458 "[1,1'-Biphenyl]-3-carboxylic acid, 4'-(acetyloxy)-, 2-(4-bromophenyl)-2-oxoethyl ester")
