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Propanoic acid, 2-[4-(4-methyl-2-nitrophenoxysulfonyl)phenoxy]-, ethyl ester
SpectraBase Compound ID 8lgofEsbEDV
InChI InChI=1S/C18H19NO8S/c1-4-25-18(20)13(3)26-14-6-8-15(9-7-14)28(23,24)27-17-10-5-12(2)11-16(17)19(21)22/h5-11,13H,4H2,1-3H3
InChIKey GWNMCCSBJVRGAP-UHFFFAOYSA-N
Mol Weight 409.41 g/mol
Molecular Formula C18H19NO8S
Exact Mass 409.083138 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1mvdGTn35me
Name Propanoic acid, 2-[4-(4-methyl-2-nitrophenoxysulfonyl)phenoxy]-, ethyl ester
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Formula C18H19NO8S
InChI InChI=1S/C18H19NO8S/c1-4-25-18(20)13(3)26-14-6-8-15(9-7-14)28(23,24)27-17-10-5-12(2)11-16(17)19(21)22/h5-11,13H,4H2,1-3H3
InChIKey GWNMCCSBJVRGAP-UHFFFAOYSA-N
Molecular Weight 409.409 g/mol
SMILES CCOC(C(Oc1ccc(S(Oc2c(N(=O)=O)cc(C)cc2)(=O)=O)cc1)C)=O
SPLASH splash10-0a4i-6590000000-4aaf122e57ad8cbe6f8d
Source of Spectrum AD-0-2532-0
Synonyms 2-[4-(4-methyl-2-nitro-phenoxy)sulfonylphenoxy]propionic acid ethyl ester 2-[4-(4-methyl-2-nitrophenoxy)sulfonylphenoxy]propanoic acid ethyl ester Ethyl 2-[4-(4-methyl-2-nitro-phenoxy)sulfonylphenoxy]propanoate
Wiley ID 1428752