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2-Methyl-1,1,1-trichlorooctan-2-ol
SpectraBase Compound ID KzblBmmlpYY
InChI InChI=1S/C9H17Cl3O/c1-3-4-5-6-7-8(2,13)9(10,11)12/h13H,3-7H2,1-2H3
InChIKey GJZAMRBDEFBJJM-UHFFFAOYSA-N
Mol Weight 247.59 g/mol
Molecular Formula C9H17Cl3O
Exact Mass 246.034498 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1JCkkukaIuK
Name 2-Methyl-1,1,1-trichlorooctan-2-ol
Alternate Name(s) 1,1,1-trichloro-2-methyl-2-octanol
CAS Registry Number 99064-60-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H17Cl3O
InChI InChI=1S/C9H17Cl3O/c1-3-4-5-6-7-8(2,13)9(10,11)12/h13H,3-7H2,1-2H3
InChIKey GJZAMRBDEFBJJM-UHFFFAOYSA-N
Molecular Weight 247.593 g/mol
SMILES OC(C(Cl)(Cl)Cl)(CCCCCC)C
SPLASH splash10-00di-9400000000-16d7cabbb4ee35339f27
Source of Spectrum F-53-1728-21
Wiley ID 800473