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(+)-trans-3-Isopropyl-3-(4-methylphenyl)oxiranemethanol

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

(+)-trans-3-Isopropyl-3-(4-methylphenyl)oxiranemethanol
SpectraBase Compound ID 2ataGzRDKkh
InChI InChI=1S/C13H18O2/c1-9(2)13(12(8-14)15-13)11-6-4-10(3)5-7-11/h4-7,9,12,14H,8H2,1-3H3/t12-,13-/m1/s1
InChIKey KTRNIZLNVWQYER-CHWSQXEVSA-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 36go1a8brrY
Name (+)-trans-3-isopropyl-3-(4-methylphenyl)oxiranemethanol
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/c1-9(2)13(12(8-14)15-13)11-6-4-10(3)5-7-11/h4-7,9,12,14H,8H2,1-3H3/t12-,13-/m1/s1
InChIKey KTRNIZLNVWQYER-CHWSQXEVSA-N
Molecular Weight 206.285 g/mol
SMILES [C@]1(O[C@@]1(CO)[H])(C1=CC=C(C=C1)C)C(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.942628