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1H-2-benzopyran-1,3(4H)-dione, 4-[2-(5,6-dichloro-3-ethyl-2(3H)-benzothiazolylidene)ethylidene]-
SpectraBase Compound ID 1t0rGHCfdhs
InChI InChI=1S/C20H13Cl2NO3S/c1-2-23-16-9-14(21)15(22)10-17(16)27-18(23)8-7-13-11-5-3-4-6-12(11)19(24)26-20(13)25/h3-10H,2H2,1H3/b13-7-,18-8-
InChIKey ALYSMFBWORXUMO-FLUDQZEQSA-N
Mol Weight 418.29 g/mol
Molecular Formula C20H13Cl2NO3S
Exact Mass 416.99932 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7j2AvIuYTND
Name 1H-2-benzopyran-1,3(4H)-dione, 4-[2-(5,6-dichloro-3-ethyl-2(3H)-benzothiazolylidene)ethylidene]-
Alternate Name(s) 4-(2-(5,6-dichloro-3-ethylbenzo[d]thiazol-2(3H)-ylidene)ethylidene)isochroman-1,3-dione 4-[2-(5,6-dichloro-3-ethyl-1,3-benzothiazol-2-ylidene)ethylidene]-3,4-dihydro-1H-2-benzopyran-1,3-dione 4-[2-(5,6-dichloro-3-ethyl-1,3-benzothiazol-2-ylidene)ethylidene]isochromene-1,3-dione 4-[2-(5,6-dichloro-3-ethyl-1,3-benzothiazol-2-ylidene)ethylidene]isochromane-1,3-dione 4-[2-[5,6-bis(chloranyl)-3-ethyl-1,3-benzothiazol-2-ylidene]ethylidene]isochromene-1,3-dione
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Formula C20H13Cl2NO3S
InChI InChI=1S/C20H13Cl2NO3S/c1-2-23-16-9-14(21)15(22)10-17(16)27-18(23)8-7-13-11-5-3-4-6-12(11)19(24)26-20(13)25/h3-10H,2H2,1H3/b13-7-,18-8-
InChIKey ALYSMFBWORXUMO-FLUDQZEQSA-N
Molecular Weight 418.294 g/mol
SMILES CCN1\C(Sc2cc(Cl)c(Cl)cc12)=C\C=C/1C(=O)OC(=O)c2ccccc12
SPLASH splash10-014i-1395600000-77de703bb5b0dbeb198f
Source of Spectrum JX-2015-4-239
Wiley ID 1725687