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1H-indole, 5-bromo-1-(cyclopropylcarbonyl)-2,3-dihydro-7-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]-
SpectraBase Compound ID 44r8JmUghgW
InChI InChI=1S/C20H22BrN5O3S/c21-16-12-15-4-7-26(19(27)14-2-3-14)18(15)17(13-16)30(28,29)25-10-8-24(9-11-25)20-22-5-1-6-23-20/h1,5-6,12-14H,2-4,7-11H2
InChIKey HAXJBFSSLMDMNF-UHFFFAOYSA-N
Mol Weight 492.39 g/mol
Molecular Formula C20H22BrN5O3S
Exact Mass 491.062674 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5w8n1TxcvdH
Name 1H-indole, 5-bromo-1-(cyclopropylcarbonyl)-2,3-dihydro-7-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]-
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/C20H22BrN5O3S/c21-16-12-15-4-7-26(19(27)14-2-3-14)18(15)17(13-16)30(28,29)25-10-8-24(9-11-25)20-22-5-1-6-23-20/h1,5-6,12-14H,2-4,7-11H2
InChIKey HAXJBFSSLMDMNF-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_7941
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: NMR/12258032