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1,1'-Pentamethylenebis(3-methoxy-5-nitro-1H-indazole)
SpectraBase Compound ID 49R4CMImmhG
InChI InChI=1S/C21H22N6O6/c1-32-20-16-12-14(26(28)29)6-8-18(16)24(22-20)10-4-3-5-11-25-19-9-7-15(27(30)31)13-17(19)21(23-25)33-2/h6-9,12-13H,3-5,10-11H2,1-2H3
InChIKey KBBYXXLHYFJOIZ-UHFFFAOYSA-N
Mol Weight 454.44 g/mol
Molecular Formula C21H22N6O6
Exact Mass 454.160082 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7NezjkdW5a6
Name 1,1'-Pentamethylenebis(3-methoxy-5-nitro-1H-indazole)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22N6O6
InChI InChI=1S/C21H22N6O6/c1-32-20-16-12-14(26(28)29)6-8-18(16)24(22-20)10-4-3-5-11-25-19-9-7-15(27(30)31)13-17(19)21(23-25)33-2/h6-9,12-13H,3-5,10-11H2,1-2H3
InChIKey KBBYXXLHYFJOIZ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cmdc.200800176
Molecular Weight 454.443 g/mol
SMILES C(CCCC[n]1nc(c2cc(ccc12)[N+](=O)[O-])OC)[n]1nc(c2cc(ccc12)[N+](=O)[O-])OC
SPLASH splash10-0a4i-0390500000-4fda747c2ba84c612df9
Source of Spectrum CMC-4-84-27
Synonyms 1,5-Bis(3-methoxy-5-nitro-1H-indazol-1-yl)pentane
Wiley ID 1771503