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(1R)-2-(tert-butylamino)-1-(4-methoxyphenyl)ethanol

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

(1R)-2-(tert-butylamino)-1-(4-methoxyphenyl)ethanol
SpectraBase Compound ID Akb1pTxOZPs
InChI InChI=1S/C13H21NO2/c1-13(2,3)14-9-12(15)10-5-7-11(16-4)8-6-10/h5-8,12,14-15H,9H2,1-4H3/t12-/m0/s1
InChIKey VXBDIWQHPBMEQF-LBPRGKRZSA-N
Mol Weight 223.32 g/mol
Molecular Formula C13H21NO2
Exact Mass 223.157229 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FqCWvWCIfCP
Name (1R)-2-(Tert-butylamino)-1-(4-methoxyphenyl)ethanol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 223.157228918 u
Formula C13H21NO2
InChI InChI=1S/C13H21NO2/c1-13(2,3)14-9-12(15)10-5-7-11(16-4)8-6-10/h5-8,12,14-15H,9H2,1-4H3/t12-/m0/s1
InChIKey VXBDIWQHPBMEQF-LBPRGKRZSA-N
Molecular Weight 223.316 g/mol
SMILES C(NC[C@@](C=1C=CC(=CC1)OC)(O)[H])(C)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.949589