SpectraBase Compound ID | 7rxp1xZt7Bs |
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InChI | InChI=1S/C5H8O2/c6-4-2-1-3-5(4)7/h4,6H,1-3H2 |
InChIKey | LUTDLYPHDVQSHT-UHFFFAOYSA-N |
Mol Weight | 100.12 g/mol |
Molecular Formula | C5H8O2 |
Exact Mass | 100.052429 g/mol |
SpectraBase Spectrum ID | 2yAN46YPC8c |
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Name | Cyclopentanone, 2-hydroxy- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 100.052429496 u |
Formula | C5H8O2 |
InChI | InChI=1S/C5H8O2/c6-4-2-1-3-5(4)7/h4,6H,1-3H2 |
InChIKey | LUTDLYPHDVQSHT-UHFFFAOYSA-N |
Molecular Weight | 100.117 g/mol |
SMILES | OC1C(CCC1)=O |
Spectrum/Structure Validation Score (Raman) | 0.882093 |