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1-(4-Chloro-2-methyl-phenoxy)-3-(2-methyl-piperidin-1-yl)-propan-2-ol

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

1-(4-Chloro-2-methyl-phenoxy)-3-(2-methyl-piperidin-1-yl)-propan-2-ol
SpectraBase Compound ID CRLKNDA44EI
InChI InChI=1S/C16H24ClNO2/c1-12-9-14(17)6-7-16(12)20-11-15(19)10-18-8-4-3-5-13(18)2/h6-7,9,13,15,19H,3-5,8,10-11H2,1-2H3
InChIKey PJSMOWNWLLFUFR-UHFFFAOYSA-N
Mol Weight 297.83 g/mol
Molecular Formula C16H24ClNO2
Exact Mass 297.149557 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6PaZk8sJK43
Name 1-(4-Chloro-2-methyl-phenoxy)-3-(2-methyl-piperidin-1-yl)-propan-2-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 297.149556715 u
Formula C16H24ClNO2
InChI InChI=1S/C16H24ClNO2/c1-12-9-14(17)6-7-16(12)20-11-15(19)10-18-8-4-3-5-13(18)2/h6-7,9,13,15,19H,3-5,8,10-11H2,1-2H3
InChIKey PJSMOWNWLLFUFR-UHFFFAOYSA-N
SMILES C1CCN(CC(COC2=C(C=C(Cl)C=C2)C)O)C(C1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.955488