| SpectraBase Spectrum ID |
EEBWXc5xeM7 |
| Name |
(1S*,6R*)-4,5-(4'-Bromobenzo)bicyclo[4.2.0]oct-4-en-2-one |
| Alternate Name(s) |
(2aS,8bR)-6-bromo-2,2a,4,8b-tetrahydrocyclobuta[a]naphthalen-3(1H)-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H11BrO |
| InChI |
InChI=1S/C12H11BrO/c13-8-1-2-9-7(5-8)6-12(14)11-4-3-10(9)11/h1-2,5,10-11H,3-4,6H2/t10-,11-/m0/s1 |
| InChIKey |
QCGCIZQEWSUBIO-QWRGUYRKSA-N |
| Molecular Weight |
251.123 g/mol |
| SMILES |
[C@@]12(c3c(cc(cc3)Br)CC([C@@]1([H])CC2)=O)[H] |
| SPLASH |
splash10-00di-0090000000-69464cf5e5477122f01f |
| Source of Spectrum |
J-58-2802-7 |
| Wiley ID |
1252912 |
![(1S*,6R*)-4,5-(4'-Bromobenzo)bicyclo[4.2.0]oct-4-en-2-one](/api/spectrum/EEBWXc5xeM7/structure.png?h=300&w=458 "(1S*,6R*)-4,5-(4'-Bromobenzo)bicyclo[4.2.0]oct-4-en-2-one")
