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2,2'',4,4',4'',6,6',6''-OCTANITRO-1,1':3',1''-TERPHENYL;ONT
SpectraBase Compound ID AaAGTQcnW5U
InChI InChI=1S/C18H6N8O16/c27-19(28)7-1-13(23(35)36)17(14(2-7)24(37)38)9-5-10(12(22(33)34)6-11(9)21(31)32)18-15(25(39)40)3-8(20(29)30)4-16(18)26(41)42/h1-6H
InChIKey ACFBFTOJGUDZAU-UHFFFAOYSA-N
Mol Weight 590.29 g/mol
Molecular Formula C18H6N8O16
Exact Mass 589.990176 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kp3OT1zovBG
Name 2,2'',4,4',4'',6,6',6''-Octanitro-m-terphenyl
CAS Registry Number 33491-88-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H6N8O16
InChI InChI=1S/C18H6N8O16/c27-19(28)7-1-13(23(35)36)17(14(2-7)24(37)38)9-5-10(12(22(33)34)6-11(9)21(31)32)18-15(25(39)40)3-8(20(29)30)4-16(18)26(41)42/h1-6H
InChIKey ACFBFTOJGUDZAU-UHFFFAOYSA-N
Molecular Weight 590.286 g/mol
SMILES c1(N(=O)=O)c(c(N(=O)=O)cc(c1)N(=O)=O)-c1cc(c(cc1N(=O)=O)N(=O)=O)-c1c(N(=O)=O)cc(cc1N(=O)=O)N(=O)=O
SPLASH splash10-00lr-9540100000-0b68526257c91e2bd8c5
Source of Spectrum NP-16-705-0
Synonyms 2-[2,4-dinitro-5-(2,4,6-trinitrophenyl)phenyl]-1,3,5-trinitrobenzene 2-[2,4-dinitro-5-(2,4,6-trinitrophenyl)phenyl]-1,3,5-trinitro-benzene
Wiley ID 1113124