SpectraBase Compound ID | 6sSV0RDQdx8 |
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InChI | InChI=1S/C11H12O/c1-2-3-4-7-10-8-5-6-9-11(10)12/h2-9,12H,1H3/b3-2+,7-4- |
InChIKey | OAINZFHAOKAJGM-SWBALALESA-N |
Mol Weight | 160.22 g/mol |
Molecular Formula | C11H12O |
Exact Mass | 160.088815 g/mol |
SpectraBase Spectrum ID | DhjJdmahaRp |
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Name | 2-((1Z)-Penta-1,3-dienyl)phenol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 160.088815005 u |
Formula | C11H12O |
InChI | InChI=1S/C11H12O/c1-2-3-4-7-10-8-5-6-9-11(10)12/h2-9,12H,1H3/b3-2+,7-4- |
InChIKey | OAINZFHAOKAJGM-SWBALALESA-N |
Molecular Weight | 160.216 g/mol |
SMILES | C1=CC(=C(C=C1)O)\C=C/C=C/C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.898024 |