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4-Benzyl-8-methoxy-7-(2-methyl-1-propenylidene)-2,6-diphenyl-2,6-diazabicyclo[2.2.2]octane-3,5-dione
SpectraBase Compound ID A94nPfCaUZf
InChI InChI=1S/C30H28N2O3/c1-21(2)19-25-26(35-3)30(20-22-13-7-4-8-14-22)28(33)31(23-15-9-5-10-16-23)27(25)32(29(30)34)24-17-11-6-12-18-24/h4-18,26-27H,20H2,1-3H3/t26?,27-,30+
InChIKey MDHFDNOGKBIRJP-XIOSJGLOSA-N
Mol Weight 464.57 g/mol
Molecular Formula C30H28N2O3
Exact Mass 464.209993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DnvX9QP2iSc
Name 4-Benzyl-8-methoxy-7-(2-methyl-1-propenylidene)-2,6-diphenyl-2,6-diazabicyclo[2.2.2]octane-3,5-dione
CAS Registry Number 106435-56-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H28N2O3
InChI InChI=1S/C30H28N2O3/c1-21(2)19-25-26(35-3)30(20-22-13-7-4-8-14-22)28(33)31(23-15-9-5-10-16-23)27(25)32(29(30)34)24-17-11-6-12-18-24/h4-18,26-27H,20H2,1-3H3/t26?,27-,30+
InChIKey MDHFDNOGKBIRJP-XIOSJGLOSA-N
Molecular Weight 464.565 g/mol
SMILES [C@]12(C(N(c3ccccc3)[C@@](C(C1OC)=C=C(C)C)(N(C2=O)c1ccccc1)[H])=O)Cc1ccccc1
SPLASH splash10-0udi-3109000000-890812b30f310a3c149c
Source of Spectrum K-120-447-3
Wiley ID 1391628