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3-[(4-Chloro-2,3,5,6-tetrafluorophenylamino)phenylmethyl]but-3-en-2-one
SpectraBase Compound ID Hr902Vbe7Y9
InChI InChI=1S/C17H12ClF4NO/c1-8(9(2)24)16(10-6-4-3-5-7-10)23-17-14(21)12(19)11(18)13(20)15(17)22/h3-7,16,23H,1H2,2H3
InChIKey SQXXDLRMFKHHCD-UHFFFAOYSA-N
Mol Weight 357.74 g/mol
Molecular Formula C17H12ClF4NO
Exact Mass 357.054354 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ix9uBvLEwqA
Name 3-[(4-Chloro-2,3,5,6-tetrafluorophenylamino)phenylmethyl]but-3-en-2-one
Alternate Name(s) 3-[(4-chloro-2,3,5,6-tetrafluoroanilino)(phenyl)methyl]-3-buten-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C17H12ClF4NO
InChI InChI=1S/C17H12ClF4NO/c1-8(9(2)24)16(10-6-4-3-5-7-10)23-17-14(21)12(19)11(18)13(20)15(17)22/h3-7,16,23H,1H2,2H3
InChIKey SQXXDLRMFKHHCD-UHFFFAOYSA-N
Molecular Weight 357.736 g/mol
SMILES N(c1c(c(F)c(c(c1F)F)Cl)F)C(C(C(=O)C)=C)c1ccccc1
SPLASH splash10-0006-9000000000-39a893019ff99fceb9ba
Source of Spectrum KC-61-3847-2
Wiley ID 1628666