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2',2'-Dimethyl-3-benzyl-9-chloro-2,3,4,4a,5,6-hexahydro-1H-spiro[benzo[c]quinolizine-5,5'-dioxane]-4',6'-dione
SpectraBase Compound ID 88jfCYJd7aS
InChI InChI=1S/C25H26ClNO4/c1-24(2)30-22(28)25(23(29)31-24)15-18-8-9-19(26)14-20(18)27-11-10-17(13-21(25)27)12-16-6-4-3-5-7-16/h3-9,14,17,21H,10-13,15H2,1-2H3/t17-,21-/m1/s1
InChIKey GGWQNCHYUDPHSC-DYESRHJHSA-N
Mol Weight 439.94 g/mol
Molecular Formula C25H26ClNO4
Exact Mass 439.155036 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DWjl8I4igTT
Name 2',2'-Dimethyl-3-benzyl-9-chloro-2,3,4,4a,5,6-hexahydro-1H-spiro[benzo[c]quinolizine-5,5'-dioxane]-4',6'-dione
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H26ClNO4
InChI InChI=1S/C25H26ClNO4/c1-24(2)30-22(28)25(23(29)31-24)15-18-8-9-19(26)14-20(18)27-11-10-17(13-21(25)27)12-16-6-4-3-5-7-16/h3-9,14,17,21H,10-13,15H2,1-2H3/t17-,21-/m1/s1
InChIKey GGWQNCHYUDPHSC-DYESRHJHSA-N
Molecular Weight 439.939 g/mol
SMILES C12(C(OC(OC2=O)(C)C)=O)[C@@]2(N(CC[C@@](C2)(Cc2ccccc2)[H])c2c(C1)ccc(Cl)c2)[H]
SPLASH splash10-000l-0000900000-71ec88cefb792d9d9422
Source of Spectrum O1-45-750-8i
Wiley ID 1669030