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(2R,6R)-6-methyl-2-(trichloromethyl)-1,3-dioxan-4-one
SpectraBase Compound ID EGwoe1lS1uJ
InChI InChI=1S/C6H7Cl3O3/c1-3-2-4(10)12-5(11-3)6(7,8)9/h3,5H,2H2,1H3/t3-,5-/m1/s1
InChIKey DEUQAXKRFNOKAU-NQXXGFSBSA-N
Mol Weight 233.48 g/mol
Molecular Formula C6H7Cl3O3
Exact Mass 231.946077 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IAgHPUqB03E
Name (2R,6R)-6-methyl-2-(trichloromethyl)-1,3-dioxan-4-one
CAS Registry Number 99902-27-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H7Cl3O3
InChI InChI=1S/C6H7Cl3O3/c1-3-2-4(10)12-5(11-3)6(7,8)9/h3,5H,2H2,1H3/t3-,5-/m1/s1
InChIKey DEUQAXKRFNOKAU-NQXXGFSBSA-N
Molecular Weight 233.478 g/mol
SMILES [C@]1(OC(=O)C[C@](O1)(C)[H])(C(Cl)(Cl)Cl)[H]
SPLASH splash10-006x-9000000000-d6731e32c9d1ef30b9b5
Source of Spectrum H-70-459-15
Wiley ID 1233136