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3-cyclopentyl-2-(methylthio)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
SpectraBase Compound ID 2CBm8u1yjtk
InChI InChI=1S/C22H26N2OS/c1-26-21-23-19-17-11-5-2-8-15(17)14-22(12-6-7-13-22)18(19)20(25)24(21)16-9-3-4-10-16/h2,5,8,11,16H,3-4,6-7,9-10,12-14H2,1H3
InChIKey YWJCLQYAKJKNTD-UHFFFAOYSA-N
Mol Weight 366.52 g/mol
Molecular Formula C22H26N2OS
Exact Mass 366.176585 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EyIKadHCPYu
Name 3-cyclopentyl-2-(methylthio)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-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/C22H26N2OS/c1-26-21-23-19-17-11-5-2-8-15(17)14-22(12-6-7-13-22)18(19)20(25)24(21)16-9-3-4-10-16/h2,5,8,11,16H,3-4,6-7,9-10,12-14H2,1H3
InChIKey YWJCLQYAKJKNTD-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_7580
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/10329366