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5-(4-chlorophenyl)-4-{4-[(2-chlorophenyl)(phenyl)methyl]-1-piperazinyl}thieno[2,3-d]pyrimidine
SpectraBase Compound ID CHR2iTWXZ4z
InChI InChI=1S/C29H24Cl2N4S/c30-22-12-10-20(11-13-22)24-18-36-29-26(24)28(32-19-33-29)35-16-14-34(15-17-35)27(21-6-2-1-3-7-21)23-8-4-5-9-25(23)31/h1-13,18-19,27H,14-17H2
InChIKey WQAIQVFWPIAEJD-UHFFFAOYSA-N
Mol Weight 531.51 g/mol
Molecular Formula C29H24Cl2N4S
Exact Mass 530.109873 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AJLzrPLghQX
Name 5-(4-chlorophenyl)-4-{4-[(2-chlorophenyl)(phenyl)methyl]-1-piperazinyl}thieno[2,3-d]pyrimidine
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/C29H24Cl2N4S/c30-22-12-10-20(11-13-22)24-18-36-29-26(24)28(32-19-33-29)35-16-14-34(15-17-35)27(21-6-2-1-3-7-21)23-8-4-5-9-25(23)31/h1-13,18-19,27H,14-17H2
InChIKey WQAIQVFWPIAEJD-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_17426
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: 987/00005528; Labnumber: 987/00005528218867; VK_ID: VK-017431
Temperature 318 °C