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3,7-bis[(4-methylphenyl)sulfonyl]-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one

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3,7-bis[(4-methylphenyl)sulfonyl]-1,5-dipropyl-3,7-diazabicyclo[3.3.1]nonan-9-one
SpectraBase Compound ID EInSfhBaOEp
InChI InChI=1S/C27H36N2O5S2/c1-5-15-26-17-28(35(31,32)23-11-7-21(3)8-12-23)19-27(16-6-2,25(26)30)20-29(18-26)36(33,34)24-13-9-22(4)10-14-24/h7-14H,5-6,15-20H2,1-4H3/t26-,27+
InChIKey YZTGJRPCGLOFOA-MKPDMIMOSA-N
Mol Weight 532.7 g/mol
Molecular Formula C27H36N2O5S2
Exact Mass 532.206565 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IyU6crmCO4
Name 3,7-bis[(4-methylphenyl)sulfonyl]-1,5-dipropyl-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/C27H36N2O5S2/c1-5-15-26-17-28(35(31,32)23-11-7-21(3)8-12-23)19-27(16-6-2,25(26)30)20-29(18-26)36(33,34)24-13-9-22(4)10-14-24/h7-14H,5-6,15-20H2,1-4H3/t26-,27+
InChIKey YZTGJRPCGLOFOA-MKPDMIMOSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_10258
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: 136324; Labnumber: AENIC7-215; VK_ID: VK-010262
Temperature 318 °C