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(3-Bromo-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]thieno[2,3-f]quinolin-10-yl)thiophen-2-yl)dimethylphosphine sulfide
SpectraBase Compound ID G6oMamYgbnU
InChI InChI=1S/C20H21BrNPS3/c1-23(2,24)20-15(21)11-17(26-20)16-10-13-9-12-5-3-7-22-8-4-6-14(18(12)22)19(13)25-16/h9-11H,3-8H2,1-2H3
InChIKey IKJPLCYFCSYPNE-UHFFFAOYSA-N
Mol Weight 482.45 g/mol
Molecular Formula C20H21BrNPS3
Exact Mass 480.975713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5KJBv51I1bA
Name (3-Bromo-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]thieno[2,3-f]quinolin-10-yl)thiophen-2-yl)dimethylphosphine sulfide
Appearance Orange crystalline powder
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Formula C20H21BrNPS3
InChI InChI=1S/C20H21BrNPS3/c1-23(2,24)20-15(21)11-17(26-20)16-10-13-9-12-5-3-7-22-8-4-6-14(18(12)22)19(13)25-16/h9-11H,3-8H2,1-2H3
InChIKey IKJPLCYFCSYPNE-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 482.453 g/mol
Reported Formula C20H21NPS3Br
SMILES C1N2c3c(CC1)cc1c(c3CCC2)sc(c1)-c1cc(c(s1)P(=S)(C)C)Br
SPLASH splash10-001i-1000900000-d8862fa76260d2494e78
Source of Spectrum US20220169669A1
Wiley ID 1882369