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N-(6-Benzyl-2-butyl-8,10-dimethyl-2,6-diazatricyclo[5.3.1.0(3,8)]undec-9-en-11-ylmethyl)-N-butylacetamide
SpectraBase Compound ID KxgSttp0OeH
InChI InChI=1S/C29H45N3O/c1-6-8-16-30(23(4)33)21-25-27-22(3)19-29(5)26(32(27)17-9-7-2)15-18-31(28(25)29)20-24-13-11-10-12-14-24/h10-14,19,25-28H,6-9,15-18,20-21H2,1-5H3/t25?,26-,27?,28?,29-/m0/s1
InChIKey MVMZOBARPXVSSA-QWFXVBHTSA-N
Mol Weight 451.7 g/mol
Molecular Formula C29H45N3O
Exact Mass 451.356263 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BZEoTbVQ2PH
Name N-(6-BENZYL-2-BUTYL-8,10-DIMETHYL-2,6-DIAZA-TRICYCLO-[5.3.1.0(3,8)]-UNDEC-9-EN-11-YLMETHYL)-N-BUTYLACETAMIDE
Compound Number 15B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H45N3O
InChI InChI=1S/C29H45N3O/c1-6-8-16-30(23(4)33)21-25-27-22(3)19-29(5)26(32(27)17-9-7-2)15-18-31(28(25)29)20-24-13-11-10-12-14-24/h10-14,19,25-28H,6-9,15-18,20-21H2,1-5H3/t25?,26-,27?,28?,29-/m0/s1
InChIKey MVMZOBARPXVSSA-QWFXVBHTSA-N
Literature Reference Author K.JAKUBOWICZ,K.B.ABDELJELIL,M.HERDEMANN,M.T.MARTIN,A.GATEAU- OLESKER,A.A.MOURABIT
Literature Reference Citation J.ORG.CHEM.,64,7381(1999)
Literature Reference DOI 10.1021/jo990604p
Molecular Weight 451.696 g/mol
Sample ID 59368
Solvent CDCl3