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2-[2-(4-nitrophenyl)ethyl]-2-propyl-malonic acid diethyl ester
SpectraBase Compound ID 5YYJvrz0OeA
InChI InChI=1S/C18H25NO6/c1-4-12-18(16(20)24-5-2,17(21)25-6-3)13-11-14-7-9-15(10-8-14)19(22)23/h7-10H,4-6,11-13H2,1-3H3
InChIKey GBLHZRHWULUJRT-UHFFFAOYSA-N
Mol Weight 351.4 g/mol
Molecular Formula C18H25NO6
Exact Mass 351.168188 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7z22wmSt1Fd
Name 2-[2-(4-nitrophenyl)ethyl]-2-propyl-malonic acid diethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25NO6
InChI InChI=1S/C18H25NO6/c1-4-12-18(16(20)24-5-2,17(21)25-6-3)13-11-14-7-9-15(10-8-14)19(22)23/h7-10H,4-6,11-13H2,1-3H3
InChIKey GBLHZRHWULUJRT-UHFFFAOYSA-N
Molecular Weight 351.399 g/mol
SMILES C(C(=O)OCC)(C(=O)OCC)(CCc1ccc(N(=O)=O)cc1)CCC
SPLASH splash10-00di-0920000000-24cd64d68d50c3959802
Source of Spectrum J-63-1857-6
Synonyms 2-[2-(4-nitrophenyl)ethyl]-2-propylpropanedioic acid diethyl ester Diethyl 2-[2-(4-nitrophenyl)ethyl]-2-propyl-propanedioate
Wiley ID 1342558