SpectraBase Compound ID | Ciz8SxfNop4 |
---|---|
InChI | InChI=1S/C10H16O2/c11-8-4-1-2-6-10(8)7-3-5-9(10)12/h8,11H,1-7H2/t8?,10-/m1/s1 |
InChIKey | JBTRYDNHOPZACS-LHIURRSHSA-N |
Mol Weight | 168.24 g/mol |
Molecular Formula | C10H16O2 |
Exact Mass | 168.11503 g/mol |
SpectraBase Spectrum ID | 3gZw9jw1tES |
---|---|
Name | (5R,10R)-10-Hydroxy-4-spiro[4.5]decanone |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 168.115029753 u |
Formula | C10H16O2 |
InChI | InChI=1S/C10H16O2/c11-8-4-1-2-6-10(8)7-3-5-9(10)12/h8,11H,1-7H2/t8?,10-/m1/s1 |
InChIKey | JBTRYDNHOPZACS-LHIURRSHSA-N |
Molecular Weight | 168.236 g/mol |
SMILES | [C@]12(C(=O)CCC2)C(O)CCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.85353 |