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N,N'-Bis{[(1S,4R)-7,7-dimethyl-2-oxonorborn-1-yl]carbonyl}-4,4'-bipiperidine
SpectraBase Compound ID HTkVxsjtH0z
InChI InChI=1S/C30H44N2O4/c1-27(2)21-5-11-29(27,23(33)17-21)25(35)31-13-7-19(8-14-31)20-9-15-32(16-10-20)26(36)30-12-6-22(18-24(30)34)28(30,3)4/h19-22H,5-18H2,1-4H3/t21-,22-,29+,30+/m1/s1
InChIKey IMTJHTSDUVVANI-UFDDTGEXSA-N
Mol Weight 496.7 g/mol
Molecular Formula C30H44N2O4
Exact Mass 496.330108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HSC6g1ZcJtd
Name N,N'-Bis{[(1S,4R)-7,7-dimethyl-2-oxonorborn-1-yl]carbonyl}-4,4'-bipiperidine
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H44N2O4
InChI InChI=1S/C30H44N2O4/c1-27(2)21-5-11-29(27,23(33)17-21)25(35)31-13-7-19(8-14-31)20-9-15-32(16-10-20)26(36)30-12-6-22(18-24(30)34)28(30,3)4/h19-22H,5-18H2,1-4H3/t21-,22-,29+,30+/m1/s1
InChIKey IMTJHTSDUVVANI-UFDDTGEXSA-N
Molecular Weight 496.692 g/mol
SMILES [C@@]12(C(N3CCC(CC3)C3CCN(C([C@@]45C(C[C@@](C5(C)C)([H])CC4)=O)=O)CC3)=O)C(C[C@@](C2(C)C)([H])CC1)=O
SPLASH splash10-001i-0009200000-18a297642573690e4fed
Source of Spectrum U1-2010-1717-16c
Synonyms (1R,4S)-4-[[4-[1-[[(1R,4S)-7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl]-oxomethyl]-4-piperidinyl]-1-piperidinyl]-oxomethyl]-7,7-dimethyl-3-bicyclo[2.2.1]heptanone (1R,4S)-4-[4-[1-[(1R,4S)-7,7-dimethyl-3-oxobicyclo[2.2.1]heptane-4-carbonyl]piperidin-4-yl]piperidine-1-carbonyl]-7,7-dimethylbicyclo[2.2.1]heptan-3-one (1S,4R)-1-[4-[1-[(1S,4R)-7,7-dimethyl-2-oxo-norbornane-1-carbonyl]-4-piperidyl]piperidine-1-carbonyl]-7,7-dimethyl-norbornan-2-one (1R,4S)-4-[4-[1-[[(1R,4S)-7,7-dimethyl-3-oxidanylidene-4-bicyclo[2.2.1]heptanyl]carbonyl]piperidin-4-yl]piperidin-1-yl]carbonyl-7,7-dimethyl-bicyclo[2.2.1]heptan-3-one
Wiley ID 1663473