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Isopropyl 3-(3-chlorophenylamino)-2-methyl-2-nitropropanoate
SpectraBase Compound ID FHMUFfJDEYj
InChI InChI=1S/C13H17ClN2O4/c1-9(2)20-12(17)13(3,16(18)19)8-15-11-6-4-5-10(14)7-11/h4-7,9,15H,8H2,1-3H3
InChIKey YLLKJCPCPMWAOH-UHFFFAOYSA-N
Mol Weight 300.74 g/mol
Molecular Formula C13H17ClN2O4
Exact Mass 300.087685 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AczNHhYIYuo
Name Isopropyl 3-(3-chlorophenylamino)-2-methyl-2-nitropropanoate
Alternate Name(s) Isopropyl 3-((3-chlorophenyl)amino)-2-methyl-2-nitropropanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17ClN2O4
InChI InChI=1S/C13H17ClN2O4/c1-9(2)20-12(17)13(3,16(18)19)8-15-11-6-4-5-10(14)7-11/h4-7,9,15H,8H2,1-3H3
InChIKey YLLKJCPCPMWAOH-UHFFFAOYSA-N
Literature Reference DOI 10.1002/asia.201300053
Molecular Weight 300.742 g/mol
SMILES N(CC([N+](=O)[O-])(C)C(OC(C)C)=O)c1cc(ccc1)Cl
SPLASH splash10-0006-1901000000-31f3206b19436844c2ce
Source of Spectrum CAJ-8-877/SM11-6h
Wiley ID 1771987