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n-Propyl 2-[N-(diethoxycarbonyl)(n-propyloxy)methyl]amino-4-nitrobenzoate
SpectraBase Compound ID CsI7LjK2uOv
InChI InChI=1S/C20H28N2O9/c1-5-11-30-17(23)15-10-9-14(22(26)27)12-16(15)21-13-31-20(6-2,18(24)28-7-3)19(25)29-8-4/h9-10,12,21H,5-8,11,13H2,1-4H3
InChIKey ZNZLXVSWPPKBAH-UHFFFAOYSA-N
Mol Weight 440.45 g/mol
Molecular Formula C20H28N2O9
Exact Mass 440.17948 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9hZ5kVBk0FV
Name n-Propyl 2-[N-(diethoxycarbonyl)(n-propyloxy)methyl]amino-4-nitrobenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28N2O9
InChI InChI=1S/C20H28N2O9/c1-5-11-30-17(23)15-10-9-14(22(26)27)12-16(15)21-13-31-20(6-2,18(24)28-7-3)19(25)29-8-4/h9-10,12,21H,5-8,11,13H2,1-4H3
InChIKey ZNZLXVSWPPKBAH-UHFFFAOYSA-N
Molecular Weight 440.449 g/mol
SMILES N(c1cc(N(=O)=O)ccc1C(=O)OCCC)COC(C(=O)OCC)(C(=O)OCC)CC
SPLASH splash10-014i-0389000000-39585996d8ac5e256687
Source of Spectrum SO-0-657-5
Synonyms Diethyl 2-ethyl-2-{[5-nitro-2-(propoxycarbonyl)anilino]methoxy}malonate
Wiley ID 1537981