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3-Azabicyclo[3.3.1]non-2-ene, 2,4-bis(4-chlorophenyl)-6,8-diphenyl-, (4-endo,6-exo,8-exo)-
SpectraBase Compound ID 7WfIFkkZlez
InChI InChI=1S/C32H27Cl2N/c33-25-15-11-23(12-16-25)31-29-20-30(32(35-31)24-13-17-26(34)18-14-24)28(22-9-5-2-6-10-22)19-27(29)21-7-3-1-4-8-21/h1-18,27-31H,19-20H2/t27-,28+,29+,30-,31-/m1/s1
InChIKey GSAVVCUKQPRMAZ-GGEKVXJASA-N
Mol Weight 496.5 g/mol
Molecular Formula C32H27Cl2N
Exact Mass 495.152055 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5CHtsLJV3uT
Name 3-Azabicyclo[3.3.1]non-2-ene, 2,4-bis(4-chlorophenyl)-6,8-diphenyl-, (4-endo,6-exo,8-exo)-
CAS Registry Number 88365-75-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H27Cl2N
InChI InChI=1S/C32H27Cl2N/c33-25-15-11-23(12-16-25)31-29-20-30(32(35-31)24-13-17-26(34)18-14-24)28(22-9-5-2-6-10-22)19-27(29)21-7-3-1-4-8-21/h1-18,27-31H,19-20H2/t27-,28+,29+,30-,31-/m1/s1
InChIKey GSAVVCUKQPRMAZ-GGEKVXJASA-N
Molecular Weight 496.481 g/mol
SMILES C1(=N[C@@]([C@@]2([C@](C[C@]([C@]1(C2)[H])(c1ccccc1)[H])(c1ccccc1)[H])[H])(c1ccc(cc1)Cl)[H])c1ccc(cc1)Cl
SPLASH splash10-0002-2112900000-bc3ecc843c9eab75ebcb
Source of Spectrum K-116-3944-0
Synonyms (1R,4S,5S,6S,8R)-2,4-bis(4-chlorophenyl)-6,8-diphenyl-3-azabicyclo[3.3.1]non-2-ene rel-(1R,4S,5S,6S,8R)-2,4-bis(4-chlorophenyl)-6,8-diphenyl-3-azabicyclo[3.3.1]non-2-ene
Wiley ID 1398117