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3-[2-(1-Hydroxy-1-ethylpropyl)phenyl]-3-pentanol
SpectraBase Compound ID L1LOuWCcR1k
InChI InChI=1S/C16H26O2/c1-5-15(17,6-2)13-11-9-10-12-14(13)16(18,7-3)8-4/h9-12,17-18H,5-8H2,1-4H3
InChIKey GARHURPNDMWOAC-UHFFFAOYSA-N
Mol Weight 250.38 g/mol
Molecular Formula C16H26O2
Exact Mass 250.19328 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Ic8d7ZieZew
Name 3-[2-(1-Hydroxy-1-ethylpropyl)phenyl]-3-pentanol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 250.193280075 u
Formula C16H26O2
InChI InChI=1S/C16H26O2/c1-5-15(17,6-2)13-11-9-10-12-14(13)16(18,7-3)8-4/h9-12,17-18H,5-8H2,1-4H3
InChIKey GARHURPNDMWOAC-UHFFFAOYSA-N
Molecular Weight 250.382 g/mol
SMILES C=1(C(C(O)(CC)CC)=CC=CC1)C(O)(CC)CC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.842479