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2,3,3-trichloro-2,6-diphenyl-4-thianone
SpectraBase Compound ID BEQhv0Kob0q
InChI InChI=1S/C17H13Cl3OS/c18-16(19)15(21)11-14(12-7-3-1-4-8-12)22-17(16,20)13-9-5-2-6-10-13/h1-10,14H,11H2
InChIKey CKNXJRWAUGXIMC-UHFFFAOYSA-N
Mol Weight 371.71 g/mol
Molecular Formula C17H13Cl3OS
Exact Mass 369.975269 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KiwXWp3ggnF
Name 2,3,3-trichloro-2,6-diphenyl-4-thianone
Alternate Name(s) 2,3,3-trichloro-2,6-diphenyl-tetrahydrothiopyran-4-one 2,3,3-trichloro-2,6-diphenylthian-4-one 2,3,3-tris(chloranyl)-2,6-diphenyl-thian-4-one
CAS Registry Number 65735-98-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13Cl3OS
InChI InChI=1S/C17H13Cl3OS/c18-16(19)15(21)11-14(12-7-3-1-4-8-12)22-17(16,20)13-9-5-2-6-10-13/h1-10,14H,11H2
InChIKey CKNXJRWAUGXIMC-UHFFFAOYSA-N
Molecular Weight 371.709 g/mol
SMILES C1(C(SC(CC1=O)c1ccccc1)(c1ccccc1)Cl)(Cl)Cl
SPLASH splash10-0g4i-0902000000-59fbdc087704beab164f
Source of Spectrum Y-14-1401-0
Wiley ID 1354056