SpectraBase Compound ID | JN3ICJSQEdu |
---|---|
InChI | InChI=1S/C11H13F/c12-11-9-5-2-1-3-6-10(11)8-4-7-9/h4,7-8H,1-3,5-6H2 |
InChIKey | LYIXMYZVCKXZLP-UHFFFAOYSA-N |
Mol Weight | 164.22 g/mol |
Molecular Formula | C11H13F |
Exact Mass | 164.100129 g/mol |
SpectraBase Spectrum ID | B8eiv8kVNnU |
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Name | 11-Fluoranylbicyclo[5.3.1]undeca-1(11),7,9-triene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 164.100128582 u |
Formula | C11H13F |
InChI | InChI=1S/C11H13F/c12-11-9-5-2-1-3-6-10(11)8-4-7-9/h4,7-8H,1-3,5-6H2 |
InChIKey | LYIXMYZVCKXZLP-UHFFFAOYSA-N |
Molecular Weight | 164.223 g/mol |
SMILES | C=1(C2=CC=CC1CCCCC2)F |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.940957 |