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Diazene, bis(3,3-dimethoxy-3,4-secocholest-5-en-4-yl)-, 1,2-dioxide
SpectraBase Compound ID 4jl63dKglQ
InChI InChI=1S/C58H102N2O6/c1-39(2)17-15-19-41(5)47-25-27-49-45-23-21-43(55(7,35-31-53(63-11)64-12)51(45)29-33-57(47,49)9)37-59(61)60(62)38-44-22-24-46-50-28-26-48(42(6)20-16-18-40(3)4)58(50,10)34-30-52(46)56(44,8)36-32-54(65-13)66-14/h21-22,39-42,45-54H,15-20,23-38H2,1-14H3/b60-59+/t41-,42-,45+,46+,47-,48-,49+,50+,51+,52+,55+,56+,57-,58-/m1/s1
InChIKey HREAJNFFQSLTNG-QUSWRYQSSA-N
Mol Weight 923.5 g/mol
Molecular Formula C58H102N2O6
Exact Mass 922.773789 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2tCzYiJsBb0
Name Diazene, bis(3,3-dimethoxy-3,4-secocholest-5-en-4-yl)-, 1,2-dioxide
CAS Registry Number 81920-64-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C58H102N2O6
InChI InChI=1S/C58H102N2O6/c1-39(2)17-15-19-41(5)47-25-27-49-45-23-21-43(55(7,35-31-53(63-11)64-12)51(45)29-33-57(47,49)9)37-59(61)60(62)38-44-22-24-46-50-28-26-48(42(6)20-16-18-40(3)4)58(50,10)34-30-52(46)56(44,8)36-32-54(65-13)66-14/h21-22,39-42,45-54H,15-20,23-38H2,1-14H3/b60-59+/t41-,42-,45+,46+,47-,48-,49+,50+,51+,52+,55+,56+,57-,58-/m1/s1
InChIKey HREAJNFFQSLTNG-QUSWRYQSSA-N
Molecular Weight 923.462 g/mol
SMILES C(\[N+](=[N+]\(CC=1[C@@]([C@]2(CC[C@]3([C@]([C@@]2(CC1)[H])(CC[C@@]3([C@@](CCCC(C)C)(C)[H])[H])[H])C)[H])(CCC(OC)OC)C)[O-])[O-])C=1[C@@]([C@]2(CC[C@]3([C@]([C@@]2(CC1)[H])(CC[C@@]3([C@@](CCCC(C)C)(C)[H])[H])[H])C)[H])(CCC(OC)OC)C
SPLASH splash10-004i-9102400000-7e3ef75ac465355af0c2
Source of Spectrum KC-1982-115-0
Synonyms 1-[(1S,2S,5R,6R,9S,10R)-10-(3,3-dimethoxypropyl)-6,10-dimethyl-5-[(2R)-6-methylheptan-2-yl]tricyclo[7.4.0.0(2,6)]tridec-11-en-11-yl]-N-({[(1S,2S,5R,6R,9S,10R)-10-(3,3-dimethoxypropyl)-6,10-dimethyl-5-[(2R)-6-methylheptan-2-yl]tricyclo[7.4.0.0(2,6)]tridec-11-en-11-yl]methyl}-oxo-azanylidene)methanimine oxide 3,3,3',3'-Tetramethoxy-4,4'-azodi-(3,4-secocholest-5-ene) 3,4-Secocholestane, diazene deriv.
Wiley ID 1418145