For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3,3',5,5'-Tetramethoxy-2,2',4,4',6,6'-hexanitro-biphenyl
SpectraBase Compound ID AcWUMNJ8yH5
InChI InChI=1S/C16H12N6O16/c1-35-13-7(17(23)24)5(8(18(25)26)14(36-2)11(13)21(31)32)6-9(19(27)28)15(37-3)12(22(33)34)16(38-4)10(6)20(29)30/h1-4H3
InChIKey XKZBJKDOQPLSQH-UHFFFAOYSA-N
Mol Weight 544.3 g/mol
Molecular Formula C16H12N6O16
Exact Mass 544.030978 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 44r80NB8rWv
Name 3,3',5,5'-Tetramethoxy-2,2',4,4',6,6'-hexanitro-biphenyl
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12N6O16
InChI InChI=1S/C16H12N6O16/c1-35-13-7(17(23)24)5(8(18(25)26)14(36-2)11(13)21(31)32)6-9(19(27)28)15(37-3)12(22(33)34)16(38-4)10(6)20(29)30/h1-4H3
InChIKey XKZBJKDOQPLSQH-UHFFFAOYSA-N
Molecular Weight 544.298 g/mol
SMILES c1(c(c(N(=O)=O)c(c(c1OC)N(=O)=O)OC)-c1c(c(OC)c(c(c1N(=O)=O)OC)N(=O)=O)N(=O)=O)N(=O)=O
SPLASH splash10-0a4l-9100000000-2e2e4d39ad3b5b4efabb
Source of Spectrum B-40-186-10
Synonyms 3,3',5,5'-Tetramethoxy-2,2',4,4',6,6'-hexamitrophenyl 3,3',5,5'-tetramethoxy-2,2',4,4',6,6'-hexanitro-1,1'-biphenyl
Wiley ID 1404981