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1-[3,5-Bis(ethoxycarbonyl)-1H-pyrazol-1-yl]-3-[5-ethoxycarbonyl-3-(8-hydroxy-3,6-dioxaoctyloxycarbonyl)-1H-pyrazol-1-yl]propane
SpectraBase Compound ID DZgBwD41Fmy
InChI InChI=1S/C25H36N4O11/c1-4-37-22(31)18-16-20(24(33)38-5-2)28(26-18)8-7-9-29-21(25(34)39-6-3)17-19(27-29)23(32)40-15-14-36-13-12-35-11-10-30/h16-17,30H,4-15H2,1-3H3
InChIKey WWKRDFUMGBAQBT-UHFFFAOYSA-N
Mol Weight 568.6 g/mol
Molecular Formula C25H36N4O11
Exact Mass 568.238058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CWRDQKfkxh3
Name 1-[3,5-Bis(ethoxycarbonyl)-1H-pyrazol-1-yl]-3-[5-ethoxycarbonyl-3-(8-hydroxy-3,6-dioxaoctyloxycarbonyl)-1H-pyrazol-1-yl]propane
Comments Less than 3 mono-isotopic peaks
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Formula C25H36N4O11
InChI InChI=1S/C25H36N4O11/c1-4-37-22(31)18-16-20(24(33)38-5-2)28(26-18)8-7-9-29-21(25(34)39-6-3)17-19(27-29)23(32)40-15-14-36-13-12-35-11-10-30/h16-17,30H,4-15H2,1-3H3
InChIKey WWKRDFUMGBAQBT-UHFFFAOYSA-N
Molecular Weight 568.580 g/mol
SMILES OCCOCCOCCOC(c1cc([n](n1)CCC[n]1c(cc(n1)C(=O)OCC)C(=O)OCC)C(=O)OCC)=O
SPLASH splash10-0udi-0090020000-da9ff3c4f3b8d1c2ae9a
Source of Spectrum F-53-11487-2
Synonyms 5-ethyl 3-{2-[2-(2-hydroxyethoxy)ethoxy]ethyl} 1-{3-[3,5-bis(ethoxycarbonyl)-1H-pyrazol-1-yl]propyl}-1H-pyrazole-3,5-dicarboxylate
Wiley ID 803460