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4-Methyl-4-(trichloromethyl)-1-cyclohexa-2,5-dienol
SpectraBase Compound ID 43Hrid4CspC
InChI InChI=1S/C8H9Cl3O/c1-7(8(9,10)11)4-2-6(12)3-5-7/h2-6,12H,1H3
InChIKey KVSODBDEYXPYND-UHFFFAOYSA-N
Mol Weight 227.52 g/mol
Molecular Formula C8H9Cl3O
Exact Mass 225.971898 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HxCkwLbjHS7
Name 4-Methyl-4-(trichloromethyl)-1-cyclohexa-2,5-dienol
Alternate Name(s) 4-Methyl-4-(trichloromethyl)cyclohexa-2,5-dien-1-ol
CAS Registry Number 13630-61-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H9Cl3O
InChI InChI=1S/C8H9Cl3O/c1-7(8(9,10)11)4-2-6(12)3-5-7/h2-6,12H,1H3
InChIKey KVSODBDEYXPYND-UHFFFAOYSA-N
Molecular Weight 227.518 g/mol
SMILES OC1C=CC(C(Cl)(Cl)Cl)(C)C=C1
SPLASH splash10-0a5c-9000000000-63a15c22539e959995a0
Source of Spectrum EP-2554-0-0
Wiley ID 1226769