John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=7lAHQI3NQdz SpectraBase Spectrum ID=1Ku6dAr6oxK

(accessed ).
tert-butyl N-[(1S)-2-(1H-indol-3-yl)-1-[(2S)-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-2-yl]ethyl]carbamate
SpectraBase Compound ID 7lAHQI3NQdz
InChI InChI=1S/C30H32N4O2/c1-30(2,3)36-29(35)34-26(17-21-18-31-24-15-9-7-13-22(21)24)27-19-32-28(20-11-5-4-6-12-20)23-14-8-10-16-25(23)33-27/h4-16,18,26-27,31,33H,17,19H2,1-3H3,(H,34,35)/t26-,27-/m0/s1
InChIKey SJWMNPHCBMWJEI-SVBPBHIXSA-N
Mol Weight 480.6 g/mol
Molecular Formula C30H32N4O2
Exact Mass 480.252526 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1Ku6dAr6oxK
Name tert-butyl N-[(1S)-2-(1H-indol-3-yl)-1-[(2S)-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-2-yl]ethyl]carbamate
Compound Number (2R)-10B
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H32N4O2
InChI InChI=1S/C30H32N4O2/c1-30(2,3)36-29(35)34-26(17-21-18-31-24-15-9-7-13-22(21)24)27-19-32-28(20-11-5-4-6-12-20)23-14-8-10-16-25(23)33-27/h4-16,18,26-27,31,33H,17,19H2,1-3H3,(H,34,35)/t26-,27-/m0/s1
InChIKey SJWMNPHCBMWJEI-SVBPBHIXSA-N
Literature Reference Author S.HERRERO,M.T.GARCIA-LOPEZ,R.HERRANZ
Literature Reference Citation J.ORG.CHEM.,68,4582(2003)
Literature Reference DOI 10.1021/jo034286c
Molecular Weight 480.610 g/mol
Solvent CDCl3
Source File Reference UWLU23765
SpectraBase Batch ID FolOXKjZMRm