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5-(1,3-benzodithiol-2-ylidene)-4-ethyl-6-thioxo-dithiolo[3,4-b][1,4]thiazin-3-one
SpectraBase Compound ID Ep7JxP49o3M
InChI InChI=1S/C14H9NOS6/c1-2-15-9-11(16)21-22-14(9)20-12(17)10(15)13-18-7-5-3-4-6-8(7)19-13/h3-6H,2H2,1H3
InChIKey FIQQHDRPMVMCJG-UHFFFAOYSA-N
Mol Weight 399.6 g/mol
Molecular Formula C14H9NOS6
Exact Mass 398.900841 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JUoLMaUNeDU
Name 5-(1,3-benzodithiol-2-ylidene)-4-ethyl-6-thioxo-dithiolo[3,4-b][1,4]thiazin-3-one
Appearance Red solid
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Exact Mass 398.900840957 u
Formula C14H9NOS6
InChI InChI=1S/C14H9NOS6/c1-2-15-9-11(16)21-22-14(9)20-12(17)10(15)13-18-7-5-3-4-6-8(7)19-13/h3-6H,2H2,1H3
InChIKey FIQQHDRPMVMCJG-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0003.619
Molecular Weight 399.592 g/mol
Quality 343
Reported Formula C14H9NOS6
SMILES C1=2N(C(C(SC2SSC1=O)=S)=C1SC2=C(S1)C=CC=C2)CC
SPLASH splash10-00di-1229100000-5ccb5c198178e4003089
Source of Spectrum ARK-2002-221-7 (DOI: 10.3998/ark.5550190.0003.619)
Wiley ID 1904747