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2-[(3-bromobenzyl)sulfanyl]-3-(cyclohexylmethyl)-4(3H)-quinazolinone
SpectraBase Compound ID 9l9UeR11cXz
InChI InChI=1S/C22H23BrN2OS/c23-18-10-6-9-17(13-18)15-27-22-24-20-12-5-4-11-19(20)21(26)25(22)14-16-7-2-1-3-8-16/h4-6,9-13,16H,1-3,7-8,14-15H2
InChIKey LDYBVYXZJZYONQ-UHFFFAOYSA-N
Mol Weight 443.4 g/mol
Molecular Formula C22H23BrN2OS
Exact Mass 442.071448 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5wW81N8EEx2
Name 2-[(3-bromobenzyl)sulfanyl]-3-(cyclohexylmethyl)-4(3H)-quinazolinone
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/C22H23BrN2OS/c23-18-10-6-9-17(13-18)15-27-22-24-20-12-5-4-11-19(20)21(26)25(22)14-16-7-2-1-3-8-16/h4-6,9-13,16H,1-3,7-8,14-15H2
InChIKey LDYBVYXZJZYONQ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_21292
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: D52209; Labnumber: AENIC71-0374; SBI_ID: SBI-021296
Temperature 318 °C