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3-[(2'-Bromoanilino)methylene]-thiochroman-2,4-dione
SpectraBase Compound ID 4zgjA9oQd
InChI InChI=1S/C16H10BrNO2S/c17-12-6-2-3-7-13(12)18-9-11-15(19)10-5-1-4-8-14(10)21-16(11)20/h1-9,18H/b11-9-
InChIKey IUXJDXUEDBTGSN-LUAWRHEFSA-N
Mol Weight 360.23 g/mol
Molecular Formula C16H10BrNO2S
Exact Mass 358.961563 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2vzq84vDztU
Name 3-[(2'-Bromoanilino)methylene]-thiochroman-2,4-dione
Alternate Name(s) (3Z)-3-[(2-bromoanilino)methylene]-2H-1-benzothiopyran-2,4(3H)-dione
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Formula C16H10BrNO2S
InChI InChI=1S/C16H10BrNO2S/c17-12-6-2-3-7-13(12)18-9-11-15(19)10-5-1-4-8-14(10)21-16(11)20/h1-9,18H/b11-9-
InChIKey IUXJDXUEDBTGSN-LUAWRHEFSA-N
Molecular Weight 360.225 g/mol
SMILES N(\C=C/1C(Sc2c(C1=O)cccc2)=O)c1c(Br)cccc1
SPLASH splash10-000i-0910000000-55ff9a2f543e2253d455
Source of Spectrum MZ-34-2057-7
Wiley ID 1582327