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(+/-)-(4R,5S)-2-METHYL-4-(1-METHYL-1H-PYRROL-2-YL)-7-PHENETHYL-2,7,9-TRIAZASPIRO-[4.5]-DECANE-6,8-DIONE
SpectraBase Compound ID 6v89c7JAT4D
InChI InChI=1S/C21H26N4O2/c1-23-13-17(18-9-6-11-24(18)2)21(15-23)14-22-20(27)25(19(21)26)12-10-16-7-4-3-5-8-16/h3-9,11,17H,10,12-15H2,1-2H3,(H,22,27)/t17-,21+/m0/s1
InChIKey LRIGKJDMKWVIEH-LAUBAEHRSA-N
Mol Weight 366.47 g/mol
Molecular Formula C21H26N4O2
Exact Mass 366.205576 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3BD0Cuv50e0
Name (+/-)-(4R,5S)-2-METHYL-4-(1-METHYL-1H-PYRROL-2-YL)-7-PHENETHYL-2,7,9-TRIAZASPIRO-[4.5]-DECANE-6,8-DIONE
Compound Number 5[5,2]
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H26N4O2
InChI InChI=1S/C21H26N4O2/c1-23-13-17(18-9-6-11-24(18)2)21(15-23)14-22-20(27)25(19(21)26)12-10-16-7-4-3-5-8-16/h3-9,11,17H,10,12-15H2,1-2H3,(H,22,27)/t17-,21+/m0/s1
InChIKey LRIGKJDMKWVIEH-LAUBAEHRSA-N
Literature Reference Author D.BLANCO-ANIA,C.VALDERAS-CORTINA,P.H.H.HERMKENS,L.A.J.M.SLIE DREGT,H.W.SCHEEREN,F
Literature Reference Citation MOLECULES,15,2269(2010)
Literature Reference DOI 10.3390/molecules15042269
Molecular Weight 366.463 g/mol
Sample ID 70235
Solvent CDCl3