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5-chloro-2-({4-[(5-chloro-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)methyl]-1-piperazinyl}methyl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione

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5-chloro-2-({4-[(5-chloro-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)methyl]-1-piperazinyl}methyl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
SpectraBase Compound ID ALlJRUSiaui
InChI InChI=1S/C22H26Cl2N4O4/c23-13-1-3-15-17(9-13)21(31)27(19(15)29)11-25-5-7-26(8-6-25)12-28-20(30)16-4-2-14(24)10-18(16)22(28)32/h1-2,15-18H,3-12H2
InChIKey MQVRZXDPYJJZJZ-UHFFFAOYSA-N
Mol Weight 481.38 g/mol
Molecular Formula C22H26Cl2N4O4
Exact Mass 480.133111 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3GkfjjBH9hE
Name 5-chloro-2-({4-[(5-chloro-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)methyl]-1-piperazinyl}methyl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
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/C22H26Cl2N4O4/c23-13-1-3-15-17(9-13)21(31)27(19(15)29)11-25-5-7-26(8-6-25)12-28-20(30)16-4-2-14(24)10-18(16)22(28)32/h1-2,15-18H,3-12H2
InChIKey MQVRZXDPYJJZJZ-UHFFFAOYSA-N
NMR Offset 16.0772
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_11103
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: 802337; Labnumber: AEGU7-0502; VK_ID: VK-011107
Temperature 308 °C