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16-Fluoro-16-(chlorodifluoromethyl)-15-thiatetracyclo[6.6.2.0.(2,7).0(9,14)]tetradeca-2,4,6,9,11,13-hexaen-15-oxide
SpectraBase Compound ID LB7WSlt4Hh6
InChI InChI=1S/C16H10ClF3OS/c17-16(19,20)15(18)13-9-5-1-3-7-11(9)14(22(15)21)12-8-4-2-6-10(12)13/h1-8,13-14H/t13-,14-,15-,22?/m0/s1
InChIKey ODRITHAQXQUAPV-VZTGJCKDSA-N
Mol Weight 342.76 g/mol
Molecular Formula C16H10ClF3OS
Exact Mass 342.009298 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1hh6SmNu0LS
Name 16-Fluoro-16-(chlorodifluoromethyl)-15-thiatetracyclo[6.6.2.0.(2,7).0(9,14)]tetradeca-2,4,6,9,11,13-hexaen-15-oxide
CAS Registry Number 141062-63-7
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H10ClF3OS
InChI InChI=1S/C16H10ClF3OS/c17-16(19,20)15(18)13-9-5-1-3-7-11(9)14(22(15)21)12-8-4-2-6-10(12)13/h1-8,13-14H/t13-,14-,15-,22?/m0/s1
InChIKey ODRITHAQXQUAPV-VZTGJCKDSA-N
Molecular Weight 342.763 g/mol
SMILES [C@]1(S([C@]2(c3c([C@]1(c1c2cccc1)[H])cccc3)[H])=O)(C(F)(F)Cl)F
SPLASH splash10-004i-0900000000-5b7c83116af5c51909ca
Source of Spectrum K-125-1893-13
Synonyms 16-[chloro(difluoro)methyl]-16-fluoro-15-thiatetracyclo[6.6.2.0(2,7).0(9,14)]hexadeca-2,4,6,9,11,13-hexaene 15-oxide
Wiley ID 1336311