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1,2,3,11A-TETRAHYDRO-11-(PIPERIDIN-1-YL)-PYRROLO-[2,1-C]-[1,4]-BENZODIAZEPIN-5-ONE
SpectraBase Compound ID 5PdUIeAIm4v
InChI InChI=1S/C17H21N3O/c21-17-13-7-2-3-8-14(13)18-16(15-9-6-12-20(15)17)19-10-4-1-5-11-19/h2-3,7-8,15H,1,4-6,9-12H2/t15-/m0/s1
InChIKey STCBKQYJYCUJKV-HNNXBMFYSA-N
Mol Weight 283.38 g/mol
Molecular Formula C17H21N3O
Exact Mass 283.168462 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 45DmdjZZ9bi
Name 1,2,3,11A-TETRAHYDRO-11-(PIPERIDIN-1-YL)-PYRROLO-[2,1-C]-[1,4]-BENZODIAZEPIN-5-ONE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H21N3O
InChI InChI=1S/C17H21N3O/c21-17-13-7-2-3-8-14(13)18-16(15-9-6-12-20(15)17)19-10-4-1-5-11-19/h2-3,7-8,15H,1,4-6,9-12H2/t15-/m0/s1
InChIKey STCBKQYJYCUJKV-HNNXBMFYSA-N
Literature Reference Author A.SCHMIDT,A.G.SHILABIN,J.C.NAMYSLO,M.NIEGER,S.HEMMEN
Literature Reference Citation EUR.J.ORG.CHEM.,1781(2005)
Literature Reference DOI 10.1002/ejoc.200400738
Molecular Weight 283.373 g/mol
Sample ID 39106
Solvent DMSO-D6