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2-(benzylthio)-3-cyclopentyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
SpectraBase Compound ID 43Ae8lyelie
InChI InChI=1S/C28H30N2OS/c31-26-24-25(23-15-7-4-12-21(23)18-28(24)16-8-9-17-28)29-27(30(26)22-13-5-6-14-22)32-19-20-10-2-1-3-11-20/h1-4,7,10-12,15,22H,5-6,8-9,13-14,16-19H2
InChIKey IHCPZDHJNYHNGA-UHFFFAOYSA-N
Mol Weight 442.62 g/mol
Molecular Formula C28H30N2OS
Exact Mass 442.207885 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JZc4vg4J6yh
Name 2-(benzylthio)-3-cyclopentyl-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/C28H30N2OS/c31-26-24-25(23-15-7-4-12-21(23)18-28(24)16-8-9-17-28)29-27(30(26)22-13-5-6-14-22)32-19-20-10-2-1-3-11-20/h1-4,7,10-12,15,22H,5-6,8-9,13-14,16-19H2
InChIKey IHCPZDHJNYHNGA-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_7182
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/12238472