16-chloro-16-trifluoromethyl-15-thiatetracyclo[6.6.2.0(2,7).0(9,14)]tetradeca-2,4,6,9,11,13-hexaene-15-oxide

SpectraBase Compound ID	Jdss3dgmZCR
InChI	InChI=1S/C16H10ClF3OS/c17-15(16(18,19)20)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	IXGBSNOMYDUTQC-VZTGJCKDSA-N Google Search
Mol Weight	342.76 g/mol
Molecular Formula	C16H10ClF3OS
Exact Mass	342.009298 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	FWZvTEgH8FA
Name	16-chloro-16-trifluoromethyl-15-thiatetracyclo[6.6.2.0(2,7).0(9,14)]tetradeca-2,4,6,9,11,13-hexaene-15-oxide
CAS Registry Number	120497-84-9
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C16H10ClF3OS
InChI	InChI=1S/C16H10ClF3OS/c17-15(16(18,19)20)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	IXGBSNOMYDUTQC-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)F)Cl
SPLASH	splash10-004i-0900000000-dc3d16bc547eee3227c3
Source of Spectrum	K-122-1760-6
Synonyms	16-chloro-16-(trifluoromethyl)-15-thiatetracyclo[6.6.2.0(2,7).0(9,14)]hexadeca-2,4,6,9,11,13-hexaene 15-oxide
Wiley ID	1336310