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Ethyl 2-(3-chlorobenzyl)-3-(4-methoxyphenylamino)-2-nitropropanoate
SpectraBase Compound ID C3H6k0WmZRB
InChI InChI=1S/C19H21ClN2O5/c1-3-27-18(23)19(22(24)25,12-14-5-4-6-15(20)11-14)13-21-16-7-9-17(26-2)10-8-16/h4-11,21H,3,12-13H2,1-2H3
InChIKey JOADVTDKWMKKFX-UHFFFAOYSA-N
Mol Weight 392.84 g/mol
Molecular Formula C19H21ClN2O5
Exact Mass 392.113899 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3elUQaDZBo
Name Ethyl 2-(3-chlorobenzyl)-3-(4-methoxyphenylamino)-2-nitropropanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21ClN2O5
InChI InChI=1S/C19H21ClN2O5/c1-3-27-18(23)19(22(24)25,12-14-5-4-6-15(20)11-14)13-21-16-7-9-17(26-2)10-8-16/h4-11,21H,3,12-13H2,1-2H3
InChIKey JOADVTDKWMKKFX-UHFFFAOYSA-N
Literature Reference DOI 10.1002/asia.201300053
Molecular Weight 392.839 g/mol
SMILES N(c1ccc(cc1)OC)CC([N+](=O)[O-])(Cc1cc(ccc1)Cl)C(OCC)=O
SPLASH splash10-01b9-4900000000-2cbe3d22c9cfb82c1ad4
Source of Spectrum CAJ-8-877/SM6-4k
Synonyms Ethyl 2-(3-chlorobenzyl)-3-((4-methoxyphenyl)amino)-2-nitropropanoate
Wiley ID 1771968