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(+)-(alpha-S)1-(4-methoxy-alpha-prop-2-en-1-yl)benzenepropanol

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

(+)-(alpha-S)1-(4-methoxy-alpha-prop-2-en-1-yl)benzenepropanol
SpectraBase Compound ID 9fNjhWN8LKn
InChI InChI=1S/C13H18O2/c1-3-4-12(14)8-5-11-6-9-13(15-2)10-7-11/h3,6-7,9-10,12,14H,1,4-5,8H2,2H3/t12-/m1/s1
InChIKey LIPUDOPRHVTINZ-GFCCVEGCSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BZ5Q6AZxZCg
Name (+)-(alpha-S)1-(4-methoxy-alpha-prop-2-en-1-yl)benzenepropanol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 206.130679818 u
Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-3-4-12(14)8-5-11-6-9-13(15-2)10-7-11/h3,6-7,9-10,12,14H,1,4-5,8H2,2H3/t12-/m1/s1
InChIKey LIPUDOPRHVTINZ-GFCCVEGCSA-N
Molecular Weight 206.285 g/mol
SMILES C(C1=CC=C(OC)C=C1)C[C@@](CC=C)(O)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.962283