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1-methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one

View entire compound with spectra: 1 NMR

1-methyl-3,7-bis(4-nitrobenzoyl)-5-propyl-3,7-diazabicyclo[3.3.1]nonan-9-one
SpectraBase Compound ID 5sTEaNqOiOd
InChI InChI=1S/C25H26N4O7/c1-3-12-25-15-26(21(30)17-4-8-19(9-5-17)28(33)34)13-24(2,23(25)32)14-27(16-25)22(31)18-6-10-20(11-7-18)29(35)36/h4-11H,3,12-16H2,1-2H3/t24-,25+
InChIKey AMFOFPCQIBGCEB-PLQXJYEYSA-N
Mol Weight 494.5 g/mol
Molecular Formula C25H26N4O7
Exact Mass 494.180149 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IPta1Pj64Wj
Name 1-methyl-3,7-bis(4-nitrobenzoyl)-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/C25H26N4O7/c1-3-12-25-15-26(21(30)17-4-8-19(9-5-17)28(33)34)13-24(2,23(25)32)14-27(16-25)22(31)18-6-10-20(11-7-18)29(35)36/h4-11H,3,12-16H2,1-2H3/t24-,25+
InChIKey AMFOFPCQIBGCEB-PLQXJYEYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_1033
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: C94945; Labnumber: AENIC71-0057; SBI_ID: SBI-001035
Temperature 308 °C