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3-Cyclohexylbicyclo[2.2.1]heptan-2-ol
SpectraBase Compound ID 2FmIagS5K7l
InChI InChI=1S/C13H22O/c14-13-11-7-6-10(8-11)12(13)9-4-2-1-3-5-9/h9-14H,1-8H2/t10-,11+,12-,13-/m0/s1
InChIKey LMKONKOSDFPPKU-RNJOBUHISA-N
Mol Weight 194.32 g/mol
Molecular Formula C13H22O
Exact Mass 194.167065 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LOdR3OIvAHu
Name 3-Cyclohexylbicyclo[2.2.1]heptan-2-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 194.167065327 u
Formula C13H22O
InChI InChI=1S/C13H22O/c14-13-11-7-6-10(8-11)12(13)9-4-2-1-3-5-9/h9-14H,1-8H2/t10-,11+,12-,13-/m0/s1
InChIKey LMKONKOSDFPPKU-RNJOBUHISA-N
Molecular Weight 194.318 g/mol
SMILES C1C[C@@]2([C@@]([C@]([C@]1(C2)[H])(O)[H])(C1CCCCC1)[H])[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.949877