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3-Methyl-1-(2,3,5-trichlorophenyl)butane-1,3-diol

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3-Methyl-1-(2,3,5-trichlorophenyl)butane-1,3-diol
SpectraBase Compound ID Ph38ofXGgx
InChI InChI=1S/C11H13Cl3O2/c1-11(2,16)5-9(15)7-3-6(12)4-8(13)10(7)14/h3-4,9,15-16H,5H2,1-2H3
InChIKey KMCCMIBLGSSKAD-UHFFFAOYSA-N
Mol Weight 283.58 g/mol
Molecular Formula C11H13Cl3O2
Exact Mass 281.998113 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A9YXOCEcEzG
Name 3-Methyl-1-(2,3,5-trichlorophenyl)butane-1,3-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13Cl3O2
InChI InChI=1S/C11H13Cl3O2/c1-11(2,16)5-9(15)7-3-6(12)4-8(13)10(7)14/h3-4,9,15-16H,5H2,1-2H3
InChIKey KMCCMIBLGSSKAD-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200800416
Molecular Weight 283.582 g/mol
SMILES OC(CC(c1c(Cl)c(cc(c1)Cl)Cl)O)(C)C
SPLASH splash10-0a4i-3390000000-eaca3405d58c8296b1f2
Source of Spectrum ASC-350-2189/SM3-3d
Wiley ID 1765818