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1-methyl-3,7-bis[(3-nitrophenyl)acetyl]-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one
SpectraBase Compound ID 5oWMs43eCMO
InChI InChI=1S/C27H30N4O7/c1-3-10-27-17-28(23(32)13-19-6-4-8-21(11-19)30(35)36)15-26(2,25(27)34)16-29(18-27)24(33)14-20-7-5-9-22(12-20)31(37)38/h4-9,11-12H,3,10,13-18H2,1-2H3/t26-,27+
InChIKey NZEOQXKTAWYDKW-MKPDMIMOSA-N
Mol Weight 522.56 g/mol
Molecular Formula C27H30N4O7
Exact Mass 522.211449 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BdFY0NXnVWe
Name 1-methyl-3,7-bis[(3-nitrophenyl)acetyl]-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C27H30N4O7/c1-3-10-27-17-28(23(32)13-19-6-4-8-21(11-19)30(35)36)15-26(2,25(27)34)16-29(18-27)24(33)14-20-7-5-9-22(12-20)31(37)38/h4-9,11-12H,3,10,13-18H2,1-2H3/t26-,27+
InChIKey NZEOQXKTAWYDKW-MKPDMIMOSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_1034
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: C94948; Labnumber: AENIC71-0060; SBI_ID: SBI-001036
Temperature 308 °C