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1,3-Dioxane, 5-ethyl-4-methyl-2-phenyl-, [2R-(2.alpha.,4.alpha.,5.beta.)]-
SpectraBase Compound ID 1MzuCVZHklH
InChI InChI=1S/C13H18O2/c1-3-11-9-14-13(15-10(11)2)12-7-5-4-6-8-12/h4-8,10-11,13H,3,9H2,1-2H3/t10-,11+,13-/m1/s1
InChIKey VUUHHFPWZXERMY-NTZNESFSSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FLfkFzKqzUD
Name 1,3-Dioxane, 5-ethyl-4-methyl-2-phenyl-, [2R-(2.alpha.,4.alpha.,5.beta.)]-
CAS Registry Number 78465-09-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-3-11-9-14-13(15-10(11)2)12-7-5-4-6-8-12/h4-8,10-11,13H,3,9H2,1-2H3/t10-,11+,13-/m1/s1
InChIKey VUUHHFPWZXERMY-NTZNESFSSA-N
Molecular Weight 206.285 g/mol
SMILES [C@]1(O[C@@]([C@](CO1)(CC)[H])(C)[H])(c1ccccc1)[H]
SPLASH splash10-0a4i-0930000000-8fec519c093303f4481b
Source of Spectrum H-64-423-0
Synonyms (2R,4R,5S)-5-ethyl-4-methyl-2-phenyl-1,3-dioxane (2SR,3SR)-2-ethyl-1,3-O-benzyliden-1,3-butandiol
Wiley ID 1204632