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2,2-Dimethyl-6-phenoxy-3-hexanol
SpectraBase Compound ID GbH66T2GDnE
InChI InChI=1S/C14H22O2/c1-14(2,3)13(15)10-7-11-16-12-8-5-4-6-9-12/h4-6,8-9,13,15H,7,10-11H2,1-3H3
InChIKey LTESCHANASMFFU-UHFFFAOYSA-N
Mol Weight 222.33 g/mol
Molecular Formula C14H22O2
Exact Mass 222.16198 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID D54wCyQh4EZ
Name 2,2-Dimethyl-6-phenoxy-3-hexanol; 3-hexanol, 2,2-dimethyl-6-phenoxy-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 222.161979946 u
Formula C14H22O2
InChI InChI=1S/C14H22O2/c1-14(2,3)13(15)10-7-11-16-12-8-5-4-6-9-12/h4-6,8-9,13,15H,7,10-11H2,1-3H3
InChIKey LTESCHANASMFFU-UHFFFAOYSA-N
Molecular Weight 222.328 g/mol
SMILES OC(C(C)(C)C)CCCOC1=CC=CC=C1
Spectrum/Structure Validation Score (Raman) 0.950649