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(3R,6R)-(+)-3,6-dicyclohexyl-1,4-dioxane-2,5-dione
SpectraBase Compound ID JD55aRpCOEO
InChI InChI=1S/C16H24O4/c17-15-13(11-7-3-1-4-8-11)19-16(18)14(20-15)12-9-5-2-6-10-12/h11-14H,1-10H2/t13-,14-/m1/s1
InChIKey MYIRDUDFNMZKAS-ZIAGYGMSSA-N
Mol Weight 280.36 g/mol
Molecular Formula C16H24O4
Exact Mass 280.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8G8WxYligti
Name (3R,6R)-(+)-3,6-dicyclohexyl-1,4-dioxane-2,5-dione
Appearance Colorless crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24O4
InChI InChI=1S/C16H24O4/c17-15-13(11-7-3-1-4-8-11)19-16(18)14(20-15)12-9-5-2-6-10-12/h11-14H,1-10H2/t13-,14-/m1/s1
InChIKey MYIRDUDFNMZKAS-ZIAGYGMSSA-N
Ionization Type EI
Molecular Weight 280.364 g/mol
Optical Rotation [a]D20 = +190.0 (c = 1.0, CHCl3)
SMILES [C@]1(OC([C@](OC1=O)(C1CCCCC1)[H])=O)(C1CCCCC1)[H]
SPLASH splash10-0002-8900000000-340a0e4b75654cb24ef8
Source of Spectrum US7709596B2
Wiley ID 1842572