SpectraBase Compound ID | 8bMYDKQaEmg |
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InChI | InChI=1S/C9H14O2/c1-9(8-11-9)6-4-2-3-5-7-10/h10H,2-3,5,7-8H2,1H3 |
InChIKey | GMZPCDAKUCKLEH-UHFFFAOYSA-N |
Mol Weight | 154.21 g/mol |
Molecular Formula | C9H14O2 |
Exact Mass | 154.09938 g/mol |
SpectraBase Spectrum ID | JSw5aNWXN9p |
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Name | 6-(2-Methyloxiranyl)hex-5-yn-1-ol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 154.099379689 u |
Formula | C9H14O2 |
InChI | InChI=1S/C9H14O2/c1-9(8-11-9)6-4-2-3-5-7-10/h10H,2-3,5,7-8H2,1H3 |
InChIKey | GMZPCDAKUCKLEH-UHFFFAOYSA-N |
Molecular Weight | 154.209 g/mol |
SMILES | C(CCCC#CC1(OC1)C)O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.96271 |