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1-[(5Z)-4-keto-5-[(5-methylol-2-furyl)methylene]-2-thioxo-thiazolidin-3-yl]piperidine-2,6-quinone
SpectraBase Compound ID CNTwqV0Z1QV
InChI InChI=1S/C14H12N2O5S2/c17-7-9-5-4-8(21-9)6-10-13(20)16(14(22)23-10)15-11(18)2-1-3-12(15)19/h4-6,17H,1-3,7H2/b10-6-
InChIKey JWMWYEARPCJHPF-POHAHGRESA-N
Mol Weight 352.38 g/mol
Molecular Formula C14H12N2O5S2
Exact Mass 352.018764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 12W7epDNZXv
Name 1-[(5Z)-4-keto-5-[(5-methylol-2-furyl)methylene]-2-thioxo-thiazolidin-3-yl]piperidine-2,6-quinone
Alternate Name(s) 1-[(5Z)-5-[[5-(hydroxymethyl)-2-furanyl]methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]piperidine-2,6-dione 1-[(5Z)-5-[[5-(hydroxymethyl)-2-furyl]methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]piperidine-2,6-dione 1-[(5Z)-5-[[5-(hydroxymethyl)furan-2-yl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]piperidine-2,6-dione 1-[(5Z)-5-[[5-(hydroxymethyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]piperidine-2,6-dione
Comments Less than 3 mono-isotopic peaks
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Formula C14H12N2O5S2
InChI InChI=1S/C14H12N2O5S2/c17-7-9-5-4-8(21-9)6-10-13(20)16(14(22)23-10)15-11(18)2-1-3-12(15)19/h4-6,17H,1-3,7H2/b10-6-
InChIKey JWMWYEARPCJHPF-POHAHGRESA-N
Molecular Weight 352.379 g/mol
SMILES OCc1oc(\C=C\2C(N(C(S2)=S)N2C(=O)CCCC2=O)=O)cc1
SPLASH splash10-0udi-0905000000-deab94aab49b4dfaaa80
Source of Spectrum Y-33-1145-10
Wiley ID 1342932