SpectraBase Compound ID | 8VvbF1JSv0M |
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InChI | InChI=1S/C10H14O2/c1-8(10(11)12)7-9-5-3-2-4-6-9/h5H,1-4,6-7H2,(H,11,12) |
InChIKey | WXACIYWLKPTQQU-UHFFFAOYSA-N |
Mol Weight | 166.22 g/mol |
Molecular Formula | C10H14O2 |
Exact Mass | 166.09938 g/mol |
SpectraBase Spectrum ID | Kn6DxcQPzkD |
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Name | 2-(Cyclohex-1-en-1-yl)methylprop-2-enoic acid |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 166.099379689 u |
Formula | C10H14O2 |
InChI | InChI=1S/C10H14O2/c1-8(10(11)12)7-9-5-3-2-4-6-9/h5H,1-4,6-7H2,(H,11,12) |
InChIKey | WXACIYWLKPTQQU-UHFFFAOYSA-N |
Molecular Weight | 166.220 g/mol |
SMILES | C(C(=C)CC1=CCCCC1)(=O)O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.925834 |