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(E)-1-(1-Hydroxycyclopentyl)-1-hexen-3-one

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

(E)-1-(1-Hydroxycyclopentyl)-1-hexen-3-one
SpectraBase Compound ID FCHQa3gokLS
InChI InChI=1S/C11H18O2/c1-2-5-10(12)6-9-11(13)7-3-4-8-11/h6,9,13H,2-5,7-8H2,1H3/b9-6+
InChIKey WWJRKSCENVOGCT-RMKNXTFCSA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 34P6qWyKiAl
Name (E)-1-(1-Hydroxycyclopentyl)-1-hexen-3-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 182.130679818 u
Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-2-5-10(12)6-9-11(13)7-3-4-8-11/h6,9,13H,2-5,7-8H2,1H3/b9-6+
InChIKey WWJRKSCENVOGCT-RMKNXTFCSA-N
Molecular Weight 182.263 g/mol
SMILES C(\C=C\C1(O)CCCC1)(=O)CCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.816203