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2-[[3-benzoxy-5-(methylthio)-2-thienyl]methylene]malonic acid dimethyl ester
SpectraBase Compound ID 41FNtD6hvZA
InChI InChI=1S/C18H18O5S2/c1-21-17(19)13(18(20)22-2)9-15-14(10-16(24-3)25-15)23-11-12-7-5-4-6-8-12/h4-10H,11H2,1-3H3
InChIKey TVOAGEOTYGVDPH-UHFFFAOYSA-N
Mol Weight 378.46 g/mol
Molecular Formula C18H18O5S2
Exact Mass 378.059566 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FZSgFPAtxTS
Name 2-[[3-benzoxy-5-(methylthio)-2-thienyl]methylene]malonic acid dimethyl ester
Alternate Name(s) 2-[[5-(methylthio)-3-phenylmethoxy-2-thiophenyl]methylidene]propanedioic acid dimethyl ester Dimethyl 2-[(3-benzyloxy-5-methylsulfanyl-2-thienyl)methylene]propanedioate Dimethyl 2-[(5-methylsulfanyl-3-phenylmethoxy-thiophen-2-yl)methylidene]propanedioate
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Formula C18H18O5S2
InChI InChI=1S/C18H18O5S2/c1-21-17(19)13(18(20)22-2)9-15-14(10-16(24-3)25-15)23-11-12-7-5-4-6-8-12/h4-10H,11H2,1-3H3
InChIKey TVOAGEOTYGVDPH-UHFFFAOYSA-N
Molecular Weight 378.457 g/mol
SMILES C(=Cc1c(cc(s1)SC)OCc1ccccc1)(C(=O)OC)C(=O)OC
SPLASH splash10-0006-9125000000-0e3a1a0e6a6495e5764b
Source of Spectrum KC-0-2492-55
Wiley ID 823194