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2-[(5Z)-5-(1H-indol-3-ylmethylene)-4-keto-2-thioxo-thiazolidin-3-yl]isoindoline-1,3-quinone
SpectraBase Compound ID ExRFjKDaK5A
InChI InChI=1S/C20H11N3O3S2/c24-17-13-6-1-2-7-14(13)18(25)22(17)23-19(26)16(28-20(23)27)9-11-10-21-15-8-4-3-5-12(11)15/h1-10,21H/b16-9-
InChIKey RWSRHKSYCOCZJM-SXGWCWSVSA-N
Mol Weight 405.45 g/mol
Molecular Formula C20H11N3O3S2
Exact Mass 405.024184 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0vL2clmcue
Name 2-[(5Z)-5-(1H-indol-3-ylmethylene)-4-keto-2-thioxo-thiazolidin-3-yl]isoindoline-1,3-quinone
Alternate Name(s) 2-[(5Z)-5-(1H-indol-3-ylmethylene)-4-oxo-2-thioxo-thiazolidin-3-yl]isoindoline-1,3-dione 2-[(5Z)-5-(1H-indol-3-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]isoindole-1,3-dione 2-[(5Z)-5-(1H-indol-3-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]isoindole-1,3-dione 2-[(5Z)-5-(1H-indol-3-ylmethylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]isoindole-1,3-dione
Comments Less than 3 mono-isotopic peaks
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Formula C20H11N3O3S2
InChI InChI=1S/C20H11N3O3S2/c24-17-13-6-1-2-7-14(13)18(25)22(17)23-19(26)16(28-20(23)27)9-11-10-21-15-8-4-3-5-12(11)15/h1-10,21H/b16-9-
InChIKey RWSRHKSYCOCZJM-SXGWCWSVSA-N
Molecular Weight 405.446 g/mol
SMILES [nH]1c2c(c(c1)\C=C\1C(N(N3C(c4ccccc4C3=O)=O)C(S1)=S)=O)cccc2
SPLASH splash10-05fr-0900700000-9cd9ad761dad7c580f84
Source of Spectrum Y-33-1146-11
Wiley ID 1371693