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(2Z)-5-(diethoxymethyl)-2-[1-(1,3-dioxo-2-isoindolyl)-2-methoxy-2-oxoethylidene]-4-ethoxy-1,3-thiazinane-4-carboxylic acid ethyl ester
SpectraBase Compound ID 7OfBuNDZjne
InChI InChI=1S/C25H32N2O9S/c1-6-33-23(34-7-2)17-14-37-19(26-25(17,36-9-4)24(31)35-8-3)18(22(30)32-5)27-20(28)15-12-10-11-13-16(15)21(27)29/h10-13,17,23,26H,6-9,14H2,1-5H3/b19-18-
InChIKey GLRWJHGBWJFJJH-HNENSFHCSA-N
Mol Weight 536.6 g/mol
Molecular Formula C25H32N2O9S
Exact Mass 536.182852 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A0DDM92WfcC
Name (2Z)-5-(diethoxymethyl)-2-[1-(1,3-dioxo-2-isoindolyl)-2-methoxy-2-oxoethylidene]-4-ethoxy-1,3-thiazinane-4-carboxylic acid ethyl ester
Alternate Name(s) (2Z)-5-(diethoxymethyl)-4-ethoxy-2-(2-keto-2-methoxy-1-phthalimido-ethylidene)-1,3-thiazinane-4-carboxylic acid ethyl ester Ethyl (2Z)-2-[1-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-methoxy-2-oxidanylidene-ethylidene]-5-(diethoxymethyl)-4-ethoxy-1,3-thiazinane-4-carboxylate Ethyl (2Z)-5-(diethoxymethyl)-2-[1-(1,3-dioxoisoindol-2-yl)-2-methoxy-2-oxoethylidene]-4-ethoxy-1,3-thiazinane-4-carboxylate Ethyl (2Z)-5-(diethoxymethyl)-2-[1-(1,3-dioxoisoindolin-2-yl)-2-methoxy-2-oxo-ethylidene]-4-ethoxy-1,3-thiazinane-4-carboxylate
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Formula C25H32N2O9S
InChI InChI=1S/C25H32N2O9S/c1-6-33-23(34-7-2)17-14-37-19(26-25(17,36-9-4)24(31)35-8-3)18(22(30)32-5)27-20(28)15-12-10-11-13-16(15)21(27)29/h10-13,17,23,26H,6-9,14H2,1-5H3/b19-18-
InChIKey GLRWJHGBWJFJJH-HNENSFHCSA-N
Molecular Weight 536.596 g/mol
SMILES N1\C(SCC(C1(C(=O)OCC)OCC)C(OCC)OCC)=C/(N1C(c2ccccc2C1=O)=O)C(=O)OC
SPLASH splash10-0udi-4901200000-6ae210e9e4575b96545d
Source of Spectrum F-50-12619-5
Wiley ID 790026