SpectraBase Spectrum ID |
F7DjEc1CmlS |
Name |
Bicyclo[2.2.1]hept-5-ene, endo-2-bromomethyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
186.004413354 u |
Formula |
C8H11Br |
InChI |
InChI=1S/C8H11Br/c9-5-8-4-6-1-2-7(8)3-6/h1-2,6-8H,3-5H2/t6-,7+,8+/m1/s1 |
InChIKey |
XCDJEPZLSGMJSM-CSMHCCOUSA-N |
Molecular Weight |
187.080 g/mol |
SMILES |
[C@]12(C=C[C@](C2)(C[C@]1(CBr)[H])[H])[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933617 |