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2-((2-(4-chlorophenyl)-2-oxoethyl)thio)-3-(cyclopentylmethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
SpectraBase Compound ID Dw95UNeYnfp
InChI InChI=1S/C31H33ClN2O2S/c32-24-14-12-22(13-15-24)26(35)20-37-30-33-28-25-11-5-4-10-23(25)18-31(16-6-1-7-17-31)27(28)29(36)34(30)19-21-8-2-3-9-21/h4-5,10-15,21H,1-3,6-9,16-20H2
InChIKey FUIADPODHFZLOZ-UHFFFAOYSA-N
Mol Weight 533.1 g/mol
Molecular Formula C31H33ClN2O2S
Exact Mass 532.195127 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KCQkPSNPMUS
Name 2-((2-(4-chlorophenyl)-2-oxoethyl)thio)-3-(cyclopentylmethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-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/C31H33ClN2O2S/c32-24-14-12-22(13-15-24)26(35)20-37-30-33-28-25-11-5-4-10-23(25)18-31(16-6-1-7-17-31)27(28)29(36)34(30)19-21-8-2-3-9-21/h4-5,10-15,21H,1-3,6-9,16-20H2
InChIKey FUIADPODHFZLOZ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_10938
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: UZI/8024008; Labnumber: MMA14-0708; UZI_ID: UZI-010940
Temperature 318 °C