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1-{3-[2-(1-Hydroxycyclohexyl)ethyl]but-3-enyl}cyclohexan-1-ol
SpectraBase Compound ID 9WXgO9732TS
InChI InChI=1S/C18H32O2/c1-16(8-14-17(19)10-4-2-5-11-17)9-15-18(20)12-6-3-7-13-18/h19-20H,1-15H2
InChIKey VEKVHGLDLLKCMJ-UHFFFAOYSA-N
Mol Weight 280.5 g/mol
Molecular Formula C18H32O2
Exact Mass 280.24023 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID hYtXDo0Dlz
Name 1-{3-[2-(1-Hydroxycyclohexyl)ethyl]but-3-enyl}cyclohexan-1-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 280.240230268 u
Formula C18H32O2
InChI InChI=1S/C18H32O2/c1-16(8-14-17(19)10-4-2-5-11-17)9-15-18(20)12-6-3-7-13-18/h19-20H,1-15H2
InChIKey VEKVHGLDLLKCMJ-UHFFFAOYSA-N
SMILES C1(CCCCC1)(O)CCC(=C)CCC1(CCCCC1)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.894825