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1,1':3',1'':3'',1'''-Quaterphenyl, 3,3'''-diiodo-4,4'',4''',6'-tetramethoxy-2',2''-dinitro-
SpectraBase Compound ID AVc6qvFRRXK
InChI InChI=1S/C28H22I2N2O8/c1-37-21-9-5-15(13-19(21)29)25-23(39-3)11-7-17(27(25)31(33)34)18-8-12-24(40-4)26(28(18)32(35)36)16-6-10-22(38-2)20(30)14-16/h5-14H,1-4H3
InChIKey NCRGHRIGCVQPQO-UHFFFAOYSA-N
Mol Weight 768.3 g/mol
Molecular Formula C28H22I2N2O8
Exact Mass 767.946556 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LQbnALrqIQ4
Name 1,1':3',1'':3'',1'''-Quaterphenyl, 3,3'''-diiodo-4,4'',4''',6'-tetramethoxy-2',2''-dinitro-
Alternate Name(s) 1,1':3',1'':3'',1'''-quaterphenyl, 3,3'''-diiodo-4,4'',4''',6'-tetramethoxy-2',2''-dinitro- 2-(3-iodo-4-methoxyphenyl)-4-[3-(3-iodo-4-methoxyphenyl)-4-methoxy-2-nitrophenyl]-1-methoxy-3-nitrobenzene 3,3''-di-iodo-4,4'',4''',6'-tetramethoxy-2',2''-dinitro-m-quaterphenyl 3,3''-Di-iodo-4,4'',4''',6'-tetramethoxy-2',2''-dinitro-m-quaterphenyl
CAS Registry Number 84251-54-7
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H22I2N2O8
InChI InChI=1S/C28H22I2N2O8/c1-37-21-9-5-15(13-19(21)29)25-23(39-3)11-7-17(27(25)31(33)34)18-8-12-24(40-4)26(28(18)32(35)36)16-6-10-22(38-2)20(30)14-16/h5-14H,1-4H3
InChIKey NCRGHRIGCVQPQO-UHFFFAOYSA-N
Molecular Weight 768.299 g/mol
SMILES c1(c(-c2c(N(=O)=O)c(-c3cc(I)c(cc3)OC)c(cc2)OC)ccc(c1-c1cc(I)c(cc1)OC)OC)N(=O)=O
SPLASH splash10-014i-0000000900-9ed2fa7788fe9d99d633
Source of Spectrum KC-1982-2313-0
Wiley ID 1416674