SpectraBase Compound ID | Ig0FQnlGuJ |
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InChI | InChI=1S/C10H18O2/c1-3-4-5-6-7-8-10(12)9(2)11/h7-8,10,12H,3-6H2,1-2H3/b8-7- |
InChIKey | PJYMJVUKLUTXTR-FPLPWBNLSA-N |
Mol Weight | 170.25 g/mol |
Molecular Formula | C10H18O2 |
Exact Mass | 170.13068 g/mol |
SpectraBase Spectrum ID | 7tntfbYISzQ |
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Name | 3-Hydroxydec-4-en-2-one |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 170.130679818 u |
Formula | C10H18O2 |
InChI | InChI=1S/C10H18O2/c1-3-4-5-6-7-8-10(12)9(2)11/h7-8,10,12H,3-6H2,1-2H3/b8-7- |
InChIKey | PJYMJVUKLUTXTR-FPLPWBNLSA-N |
Molecular Weight | 170.252 g/mol |
SMILES | CC(C(\C=C/CCCCC)O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.978791 |