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N-(2-tert-butyl-1,2,3,4,6,7,8,9-octahydro-11-thia-5a,10-diaza-benzo[b]fluoren-5-ylidene)-2,2,2-trifluoro-acetamide
SpectraBase Compound ID I4ATP0mccZV
InChI InChI=1S/C20H24F3N3OS/c1-19(2,3)11-7-8-12-13(10-11)28-17-15(12)16(25-18(27)20(21,22)23)26-9-5-4-6-14(26)24-17/h11H,4-10H2,1-3H3/b25-16-
InChIKey ORVAWCZADDKBNW-XYGWBWBKSA-N
Mol Weight 411.49 g/mol
Molecular Formula C20H24F3N3OS
Exact Mass 411.159218 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LDLQoW1IaKL
Name N-(2-tert-butyl-1,2,3,4,6,7,8,9-octahydro-11-thia-5a,10-diaza-benzo[b]fluoren-5-ylidene)-2,2,2-trifluoro-acetamide
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Formula C20H24F3N3OS
InChI InChI=1S/C20H24F3N3OS/c1-19(2,3)11-7-8-12-13(10-11)28-17-15(12)16(25-18(27)20(21,22)23)26-9-5-4-6-14(26)24-17/h11H,4-10H2,1-3H3/b25-16-
InChIKey ORVAWCZADDKBNW-XYGWBWBKSA-N
Molecular Weight 411.487 g/mol
SMILES C1(Cc2c(CC1)c1c(s2)N=C2N(\C1=N\C(C(F)(F)F)=O)CCCC2)C(C)(C)C
SPLASH splash10-0006-7379100000-93ddf058b758180f49bb
Synonyms N-[(12Z)-3-tert-butyl-1,2,3,4,7,8,9,10-octahydro-12H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidin-12-ylidene]-2,2,2-trifluoroacetamide N-[3-tert-butyl-1,2,3,4,7,8,9,10-octahydro-12H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidin-12-ylidene]-2,2,2-trifluoroacetamide
Wiley ID 1455297