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5-({5-[(4-chlorophenyl)sulfanyl]-2-furyl}methylene)-2-phenyl-1,3-dioxane-4,6-dione
SpectraBase Compound ID LQYKuxLqx4u
InChI InChI=1S/C21H13ClO5S/c22-14-6-9-16(10-7-14)28-18-11-8-15(25-18)12-17-19(23)26-21(27-20(17)24)13-4-2-1-3-5-13/h1-12,21H/b17-12-
InChIKey PQOPJNYNHNDNJM-ATVHPVEESA-N
Mol Weight 412.84 g/mol
Molecular Formula C21H13ClO5S
Exact Mass 412.017222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LpH0yhCEDPg
Name 5-({5-[(4-chlorophenyl)sulfanyl]-2-furyl}methylene)-2-phenyl-1,3-dioxane-4,6-dione
Alternate Name(s) 5-[5-(4-chloro-phenylsulfanyl)-furan-2-ylmethylene]-2-phenyl-[1,3]dioxane-4,6-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H13ClO5S
InChI InChI=1S/C21H13ClO5S/c22-14-6-9-16(10-7-14)28-18-11-8-15(25-18)12-17-19(23)26-21(27-20(17)24)13-4-2-1-3-5-13/h1-12,21H/b17-12-
InChIKey PQOPJNYNHNDNJM-ATVHPVEESA-N
Molecular Weight 412.843 g/mol
SMILES C1(C(OC(OC1=O)c1ccccc1)=O)=Cc1oc(Sc2ccc(cc2)Cl)cc1
SPLASH splash10-03di-6910000000-3855660e154f25187dea
Wiley ID 1442612