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(Z)-3-(4-(Trifluoromethyl)benzylidene)benzo[b][1,4]oxathiin-2(3H)-one
SpectraBase Compound ID HfzKNmL3VI6
InChI InChI=1S/C16H9F3O2S/c17-16(18,19)11-7-5-10(6-8-11)9-14-15(20)21-12-3-1-2-4-13(12)22-14/h1-9H/b14-9-
InChIKey UZEHHCWFZXIAOE-ZROIWOOFSA-N
Mol Weight 322.3 g/mol
Molecular Formula C16H9F3O2S
Exact Mass 322.027535 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EufhkkMjGLS
Name (Z)-3-(4-(Trifluoromethyl)benzylidene)benzo[b][1,4]oxathiin-2(3H)-one
Appearance White powder
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Formula C16H9F3O2S
InChI InChI=1S/C16H9F3O2S/c17-16(18,19)11-7-5-10(6-8-11)9-14-15(20)21-12-3-1-2-4-13(12)22-14/h1-9H/b14-9-
InChIKey UZEHHCWFZXIAOE-ZROIWOOFSA-N
Instrument Name Finnigan-Mat 8430
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3523
Molecular Weight 322.301 g/mol
SMILES c1cc2c(cc1)S\C(C(O2)=O)=C\c1ccc(cc1)C(F)(F)F
SPLASH splash10-00dl-3597000000-63df8862a2b0d01ef9e2
Source of Spectrum Y-56-SM49-5d
Wiley ID 1861190