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3-(furan-2-ylmethyl)-2-(propylthio)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
SpectraBase Compound ID 2b3OOlIQg4C
InChI InChI=1S/C25H28N2O2S/c1-2-15-30-24-26-22-20-11-5-4-9-18(20)16-25(12-6-3-7-13-25)21(22)23(28)27(24)17-19-10-8-14-29-19/h4-5,8-11,14H,2-3,6-7,12-13,15-17H2,1H3
InChIKey XVPQXGKYYHGDCN-UHFFFAOYSA-N
Mol Weight 420.57 g/mol
Molecular Formula C25H28N2O2S
Exact Mass 420.187149 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4rLPq2gT0eJ
Name 3-(furan-2-ylmethyl)-2-(propylthio)-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/C25H28N2O2S/c1-2-15-30-24-26-22-20-11-5-4-9-18(20)16-25(12-6-3-7-13-25)21(22)23(28)27(24)17-19-10-8-14-29-19/h4-5,8-11,14H,2-3,6-7,12-13,15-17H2,1H3
InChIKey XVPQXGKYYHGDCN-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_5250
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/12218927