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2-(2,2-Dimethyl-1-hydroxypropyl)benzyl alcohol

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

2-(2,2-Dimethyl-1-hydroxypropyl)benzyl alcohol
SpectraBase Compound ID 2c2X4FYRTXK
InChI InChI=1S/C12H18O2/c1-12(2,3)11(14)10-7-5-4-6-9(10)8-13/h4-7,11,13-14H,8H2,1-3H3
InChIKey XGWFATRUOUQXOW-UHFFFAOYSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JM2RHwsBU7T
Name 2-(2,2-Dimethyl-1-hydroxypropyl)benzyl alcohol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 194.130679818 u
Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-12(2,3)11(14)10-7-5-4-6-9(10)8-13/h4-7,11,13-14H,8H2,1-3H3
InChIKey XGWFATRUOUQXOW-UHFFFAOYSA-N
Molecular Weight 194.274 g/mol
SMILES C(C=1C(=CC=CC1)C(C(C)(C)C)O)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.966702