| SpectraBase Spectrum ID |
LI5zngtysJq |
| Name |
(Trans)-1-bromo-2-phenyl-2-( 2'-propenyl)cyclopropane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
236.020063419 u |
| Formula |
C12H13Br |
| InChI |
InChI=1S/C12H13Br/c1-2-8-12(9-11(12)13)10-6-4-3-5-7-10/h2-7,11H,1,8-9H2/t11-,12-/m1/s1 |
| InChIKey |
KHMNLEIWUQOIKG-VXGBXAGGSA-N |
| Molecular Weight |
237.140 g/mol |
| SMILES |
[C@]1(C[C@]1(Br)[H])(C1=CC=CC=C1)CC=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.977351 |
