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3-cyclohexyl-2-(ethylthio)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
SpectraBase Compound ID DN5JHYtsW9q
InChI InChI=1S/C25H32N2OS/c1-2-29-24-26-22-20-14-8-7-11-18(20)17-25(15-9-4-10-16-25)21(22)23(28)27(24)19-12-5-3-6-13-19/h7-8,11,14,19H,2-6,9-10,12-13,15-17H2,1H3
InChIKey CLNOXIASXQZTBU-UHFFFAOYSA-N
Mol Weight 408.6 g/mol
Molecular Formula C25H32N2OS
Exact Mass 408.223535 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2QTCHL9QCrQ
Name 3-cyclohexyl-2-(ethylthio)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 408.223534831 u
Formula C25H32N2OS
InChI InChI=1S/C25H32N2OS/c1-2-29-24-26-22-20-14-8-7-11-18(20)17-25(15-9-4-10-16-25)21(22)23(28)27(24)19-12-5-3-6-13-19/h7-8,11,14,19H,2-6,9-10,12-13,15-17H2,1H3
InChIKey CLNOXIASXQZTBU-UHFFFAOYSA-N
Molecular Weight 408.604 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_2154
Solvent DMSO-d6
Source Vendor ID: NMR/12279011