SpectraBase Compound ID | 7f0tjK0OAeV |
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InChI | InChI=1S/C9H16O/c1-2-8-5-3-4-6-9(8)7-10/h2,8-10H,1,3-7H2/t8-,9-/m0/s1 |
InChIKey | UTIXZVUFAVYIIY-IUCAKERBSA-N |
Mol Weight | 140.23 g/mol |
Molecular Formula | C9H16O |
Exact Mass | 140.120115 g/mol |
SpectraBase Spectrum ID | D475KHGweCU |
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Name | (1rs,2sr)-2-Vinylcyclohexanemethanol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 140.120115134 u |
Formula | C9H16O |
InChI | InChI=1S/C9H16O/c1-2-8-5-3-4-6-9(8)7-10/h2,8-10H,1,3-7H2/t8-,9-/m0/s1 |
InChIKey | UTIXZVUFAVYIIY-IUCAKERBSA-N |
Molecular Weight | 140.226 g/mol |
SMILES | C([C@@]1([C@](CO)(CCCC1)[H])[H])=C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.875104 |