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bis[1'-(Isopropoxycarbonyl)ethyl] 3,3-dimethyl-3H-pyrazole-4,5-dicarboxylate
SpectraBase Compound ID JVJ0HuSYXzo
InChI InChI=1S/C19H28N2O8/c1-9(2)26-15(22)11(5)28-17(24)13-14(20-21-19(13,7)8)18(25)29-12(6)16(23)27-10(3)4/h9-12H,1-8H3
InChIKey LKWPGIFWOJBAKX-UHFFFAOYSA-N
Mol Weight 412.44 g/mol
Molecular Formula C19H28N2O8
Exact Mass 412.184566 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5qUstWAwhIu
Name bis[1'-(Isopropoxycarbonyl)ethyl] 3,3-dimethyl-3H-pyrazole-4,5-dicarboxylate
Alternate Name(s) bis(2-isopropoxy-1-methyl-2-oxoethyl) 3,3-dimethyl-3H-pyrazole-4,5-dicarboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C19H28N2O8
InChI InChI=1S/C19H28N2O8/c1-9(2)26-15(22)11(5)28-17(24)13-14(20-21-19(13,7)8)18(25)29-12(6)16(23)27-10(3)4/h9-12H,1-8H3
InChIKey LKWPGIFWOJBAKX-UHFFFAOYSA-N
Molecular Weight 412.439 g/mol
SMILES C1(=C(C(OC(C(OC(C)C)=O)C)=O)C(C)(C)N=N1)C(OC(C(OC(C)C)=O)C)=O
SPLASH splash10-0udi-0009000000-fe1fb6deed0a7485e161
Source of Spectrum U1-2001-4721-11
Wiley ID 815157