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Dimethyl 2-bromo-2-(2-nitro-1-phenylethyl)malonate
SpectraBase Compound ID Ej426wMFtO1
InChI InChI=1S/C13H14BrNO6/c1-20-11(16)13(14,12(17)21-2)10(8-15(18)19)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3
InChIKey JCIAXZIDRYKZPV-UHFFFAOYSA-N
Mol Weight 360.16 g/mol
Molecular Formula C13H14BrNO6
Exact Mass 359.00045 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DnJu4hF7Dkf
Name Dimethyl 2-bromo-2-(2-nitro-1-phenylethyl)malonate
CAS Registry Number 4674-93-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14BrNO6
InChI InChI=1S/C13H14BrNO6/c1-20-11(16)13(14,12(17)21-2)10(8-15(18)19)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3
InChIKey JCIAXZIDRYKZPV-UHFFFAOYSA-N
Molecular Weight 360.160 g/mol
SMILES C(C(CN(=O)=O)c1ccccc1)(C(=O)OC)(C(=O)OC)Br
SPLASH splash10-0ue9-6930000000-7330a54dded0b7e1cb72
Source of Spectrum AD-0-2532-0
Synonyms 2-Bromo-2-(2-nitro-1-phenyl-ethyl)malonic acid dimethyl ester 2-Bromo-2-(2-nitro-1-phenylethyl)propanedioic acid dimethyl ester Dimethyl 2-bromanyl-2-(2-nitro-1-phenyl-ethyl)propanedioate Dimethyl 2-bromo-2-(2-nitro-1-phenyl-ethyl)propanedioate Propanedioic acid, 2-bromo-2-(2-nitro-1-phenylethyl)-, dimethyl ester
Wiley ID 1425934