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1-(2-ETHOXY-CARBONYL-4-NITRO-BENZYL)-2,4-DINITRO-PYRROLE
SpectraBase Compound ID 7QqEXMEZCeI
InChI InChI=1S/C14H12N4O8/c1-2-26-14(19)12-5-10(16(20)21)4-3-9(12)7-15-8-11(17(22)23)6-13(15)18(24)25/h3-6,8H,2,7H2,1H3
InChIKey JNGAPUCCOBESEI-UHFFFAOYSA-N
Mol Weight 364.27 g/mol
Molecular Formula C14H12N4O8
Exact Mass 364.065513 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HrKPMowvLKV
Name 2-[(2,4-dinitro-1-pyrrolyl)methyl]-5-nitrobenzoic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12N4O8
InChI InChI=1S/C14H12N4O8/c1-2-26-14(19)12-5-10(16(20)21)4-3-9(12)7-15-8-11(17(22)23)6-13(15)18(24)25/h3-6,8H,2,7H2,1H3
InChIKey JNGAPUCCOBESEI-UHFFFAOYSA-N
Molecular Weight 364.270 g/mol
SMILES c1(cc(N(=O)=O)c[n]1Cc1c(cc(N(=O)=O)cc1)C(=O)OCC)N(=O)=O
SPLASH splash10-0002-0009000000-eb5e202dd229aded2d61
Source of Spectrum Y-33-613-13
Synonyms 2-[(2,4-dinitropyrrol-1-yl)methyl]-5-nitro-benzoic acid ethyl ester Ethyl 2-[(2,4-dinitropyrrol-1-yl)methyl]-5-nitro-benzoate
Wiley ID 1350491