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2-[(3,5-Dinitrobenzoyl)oxy]-1-methylethyl 3,5-dinitrobenzoate
SpectraBase Compound ID JSDfZUJJ334
InChI InChI=1S/C17H12N4O12/c1-9(33-17(23)11-4-14(20(28)29)7-15(5-11)21(30)31)8-32-16(22)10-2-12(18(24)25)6-13(3-10)19(26)27/h2-7,9H,8H2,1H3
InChIKey WIIUJIADHMYMHT-UHFFFAOYSA-N
Mol Weight 464.3 g/mol
Molecular Formula C17H12N4O12
Exact Mass 464.045172 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DZq9mgswdR8
Name 1,2-PROPANEDIOL, BIS(3,5-DINITROBENZOATE)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H12N4O12
InChI InChI=1S/C17H12N4O12/c1-9(33-17(23)11-4-14(20(28)29)7-15(5-11)21(30)31)8-32-16(22)10-2-12(18(24)25)6-13(3-10)19(26)27/h2-7,9H,8H2,1H3
InChIKey WIIUJIADHMYMHT-UHFFFAOYSA-N
Molecular Weight 464.0448
SMILES c1c(N(=O)=O)cc(C(OCC(OC(c2cc(N(=O)=O)cc(N(=O)=O)c2)=O)C)=O)cc1N(=O)=O
SPLASH splash10-0002-3910000000-9a6a2285136aa8658d85
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany