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5-Ethyl 2-Methyl 4-Ethyl-3-hydroxy-4'-nitrobiphenyl-2,5-dicarboxylate
SpectraBase Compound ID Bv3CTgOP4ds
InChI InChI=1S/C19H19NO7/c1-4-13-15(18(22)27-5-2)10-14(16(17(13)21)19(23)26-3)11-6-8-12(9-7-11)20(24)25/h6-10,21H,4-5H2,1-3H3
InChIKey GKQWRIRAZAFHIT-UHFFFAOYSA-N
Mol Weight 373.36 g/mol
Molecular Formula C19H19NO7
Exact Mass 373.116152 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F9MBuu0EmCo
Name 5-Ethyl 2-Methyl 4-Ethyl-3-hydroxy-4'-nitrobiphenyl-2,5-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H19NO7
InChI InChI=1S/C19H19NO7/c1-4-13-15(18(22)27-5-2)10-14(16(17(13)21)19(23)26-3)11-6-8-12(9-7-11)20(24)25/h6-10,21H,4-5H2,1-3H3
InChIKey GKQWRIRAZAFHIT-UHFFFAOYSA-N
Molecular Weight 373.361 g/mol
SMILES Oc1c(c(cc(c1CC)C(=O)OCC)-c1ccc(N(=O)=O)cc1)C(=O)OC
SPLASH splash10-02fx-0289000000-e3fd9fc23b73c6da71a3
Source of Spectrum U1-2010-3740-13i
Synonyms 1-O-ethyl 4-O-methyl 2-ethyl-3-hydroxy-5-(4-nitrophenyl)benzene-1,4-dicarboxylate O1-ethyl O4-methyl 2-ethyl-3-hydroxy-5-(4-nitrophenyl)benzene-1,4-dicarboxylate O1-ethyl O4-methyl 2-ethyl-5-(4-nitrophenyl)-3-oxidanyl-benzene-1,4-dicarboxylate
Wiley ID 1663989