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1-(2,4-Dinitrophenyl)-1-(1-piperidyl)-2,2-diethoxycarbonylethane
SpectraBase Compound ID 8hevn05ZFgh
InChI InChI=1S/C19H25N3O8/c1-3-29-18(23)16(19(24)30-4-2)17(20-10-6-5-7-11-20)14-9-8-13(21(25)26)12-15(14)22(27)28/h8-9,12,16-17H,3-7,10-11H2,1-2H3
InChIKey JWADIMLFZWGORS-UHFFFAOYSA-N
Mol Weight 423.42 g/mol
Molecular Formula C19H25N3O8
Exact Mass 423.164165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AjkNLPfLIJr
Name 1-(2,4-Dinitrophenyl)-1-(1-piperidyl)-2,2-diethoxycarbonylethane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H25N3O8
InChI InChI=1S/C19H25N3O8/c1-3-29-18(23)16(19(24)30-4-2)17(20-10-6-5-7-11-20)14-9-8-13(21(25)26)12-15(14)22(27)28/h8-9,12,16-17H,3-7,10-11H2,1-2H3
InChIKey JWADIMLFZWGORS-UHFFFAOYSA-N
Molecular Weight 423.422 g/mol
SMILES C(C(C(=O)OCC)C(=O)OCC)(N1CCCCC1)c1c(cc(cc1)N(=O)=O)N(=O)=O
SPLASH splash10-01q9-9170000000-a69983c4e821a8b11b85
Source of Spectrum SO-0-118-3
Synonyms Diethyl 2-[(2,4-dinitrophenyl)(1-piperidinyl)methyl]malonate
Wiley ID 1539705