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Quinoline, 2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]-
SpectraBase Compound ID 7wbPe6b5dQD
InChI InChI=1S/C16H9F3N2O2S/c17-16(18,19)11-6-7-14(13(9-11)21(22)23)24-15-8-5-10-3-1-2-4-12(10)20-15/h1-9H
InChIKey ACLFXSMGWFAOEC-UHFFFAOYSA-N
Mol Weight 350.32 g/mol
Molecular Formula C16H9F3N2O2S
Exact Mass 350.033683 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2lXE1k7fInu
Name Quinoline, 2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H9F3N2O2S
InChI InChI=1S/C16H9F3N2O2S/c17-16(18,19)11-6-7-14(13(9-11)21(22)23)24-15-8-5-10-3-1-2-4-12(10)20-15/h1-9H
InChIKey ACLFXSMGWFAOEC-UHFFFAOYSA-N
Molecular Weight 350.315 g/mol
SMILES C(F)(F)(F)c1ccc(c(c1)N(=O)=O)Sc1ccc2c(cccc2)n1
SPLASH splash10-0ufr-6924000000-397dbd9e1130512bd2c3
Source of Spectrum IY-1-4438-2
Synonyms 2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylquinoline
Wiley ID 1652365