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2-(4-Bromo-benzyl)-3-difluoromethyl-[1,4]naphthoquinone
SpectraBase Compound ID CIgCE8E4jyJ
InChI InChI=1S/C18H11BrF2O2/c19-11-7-5-10(6-8-11)9-14-15(18(20)21)17(23)13-4-2-1-3-12(13)16(14)22/h1-8,18H,9H2
InChIKey UKPYNZIKZXFWAU-UHFFFAOYSA-N
Mol Weight 377.18 g/mol
Molecular Formula C18H11BrF2O2
Exact Mass 375.991049 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9vjfmISyLjL
Name 2-(4-Bromo-benzyl)-3-difluoromethyl-[1,4]naphthoquinone
Appearance Yellow solid
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Formula C18H11BrF2O2
InChI InChI=1S/C18H11BrF2O2/c19-11-7-5-10(6-8-11)9-14-15(18(20)21)17(23)13-4-2-1-3-12(13)16(14)22/h1-8,18H,9H2
InChIKey UKPYNZIKZXFWAU-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 377.185 g/mol
SMILES c1cc2c(C(C(=C(C2=O)C(F)F)Cc2ccc(cc2)Br)=O)cc1
SPLASH splash10-014i-1902000000-bc3d18779794cb5b3655
Source of Spectrum US20110059972A1
Wiley ID 1861680