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2-(2,4-dinitrophenyl)propanoic acid methyl ester
SpectraBase Compound ID 25nwIhFfQal
InChI InChI=1S/C10H10N2O6/c1-6(10(13)18-2)8-4-3-7(11(14)15)5-9(8)12(16)17/h3-6H,1-2H3
InChIKey LKBHNHHBPFOFGV-UHFFFAOYSA-N
Mol Weight 254.2 g/mol
Molecular Formula C10H10N2O6
Exact Mass 254.053886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EmKOFqwzUXm
Name 2-(2,4-dinitrophenyl)propanoic acid methyl ester
Alternate Name(s) 2-(2,4-dinitrophenyl)propionic acid methyl ester Methyl 2-(2,4-dinitrophenyl)propanoate
CAS Registry Number 93742-87-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10N2O6
InChI InChI=1S/C10H10N2O6/c1-6(10(13)18-2)8-4-3-7(11(14)15)5-9(8)12(16)17/h3-6H,1-2H3
InChIKey LKBHNHHBPFOFGV-UHFFFAOYSA-N
Molecular Weight 254.198 g/mol
SMILES c1(N(=O)=O)c(C(C(=O)OC)C)ccc(N(=O)=O)c1
SPLASH splash10-0a6u-9000000000-262745e465e8fa6b32f6
Source of Spectrum J-53-692-3
Wiley ID 1257202