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3-cyclopentyl-2-(methylthio)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
SpectraBase Compound ID 1dlJTx38rI5
InChI InChI=1S/C23H28N2OS/c1-27-22-24-20-18-12-6-3-9-16(18)15-23(13-7-2-8-14-23)19(20)21(26)25(22)17-10-4-5-11-17/h3,6,9,12,17H,2,4-5,7-8,10-11,13-15H2,1H3
InChIKey WZSITMSOIAXCNX-UHFFFAOYSA-N
Mol Weight 380.55 g/mol
Molecular Formula C23H28N2OS
Exact Mass 380.192235 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4IJSiuT4jkR
Name 3-cyclopentyl-2-(methylthio)-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/C23H28N2OS/c1-27-22-24-20-18-12-6-3-9-16(18)15-23(13-7-2-8-14-23)19(20)21(26)25(22)17-10-4-5-11-17/h3,6,9,12,17H,2,4-5,7-8,10-11,13-15H2,1H3
InChIKey WZSITMSOIAXCNX-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_7147
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/12238426