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Propanedioic acid, methyl[(3-nitrophenyl)methyl]-, diethyl ester
SpectraBase Compound ID EKZIGrMbh75
InChI InChI=1S/C15H19NO6/c1-4-21-13(17)15(3,14(18)22-5-2)10-11-7-6-8-12(9-11)16(19)20/h6-9H,4-5,10H2,1-3H3
InChIKey WRJUQKBZLHWJQO-UHFFFAOYSA-N
Mol Weight 309.32 g/mol
Molecular Formula C15H19NO6
Exact Mass 309.121237 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7w6Fn7CoBGA
Name Propanedioic acid, methyl[(3-nitrophenyl)methyl]-, diethyl ester
Alternate Name(s) Diethyl 2-methyl-2-(3-nitrobenzyl)malonate Diethyl ester of 2-methyl-2-(m-nitrobenzyl)malonic acid 2-Methyl-2-[(3-nitrophenyl)methyl]propanedioic acid diethyl ester Diethyl 2-methyl-2-[(3-nitrophenyl)methyl]propanedioate
CAS Registry Number 86096-97-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H19NO6
InChI InChI=1S/C15H19NO6/c1-4-21-13(17)15(3,14(18)22-5-2)10-11-7-6-8-12(9-11)16(19)20/h6-9H,4-5,10H2,1-3H3
InChIKey WRJUQKBZLHWJQO-UHFFFAOYSA-N
Molecular Weight 309.318 g/mol
SMILES C(C(=O)OCC)(C(=O)OCC)(Cc1cc(N(=O)=O)ccc1)C
SPLASH splash10-00kr-2961000000-2f62b36af5af55711aff
Source of Spectrum B-36-92-0
Wiley ID 1310550