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3-allyl-2-(prop-2-yn-1-ylthio)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
SpectraBase Compound ID p78OqoC6Xk
InChI InChI=1S/C23H24N2OS/c1-3-14-25-21(26)19-20(24-22(25)27-15-4-2)18-11-7-6-10-17(18)16-23(19)12-8-5-9-13-23/h2-3,6-7,10-11H,1,5,8-9,12-16H2
InChIKey FGFGAGCDQPJWPE-UHFFFAOYSA-N
Mol Weight 376.52 g/mol
Molecular Formula C23H24N2OS
Exact Mass 376.160935 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1ImVngSzKo8
Name 3-allyl-2-(prop-2-yn-1-ylthio)-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/C23H24N2OS/c1-3-14-25-21(26)19-20(24-22(25)27-15-4-2)18-11-7-6-10-17(18)16-23(19)12-8-5-9-13-23/h2-3,6-7,10-11H,1,5,8-9,12-16H2
InChIKey FGFGAGCDQPJWPE-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_4833
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: 112515; Labnumber: AMIR-5858; VK_ID: VK-004834
Temperature 308 °C