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ethyl 2-((3-allyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)thio)acetate
SpectraBase Compound ID KSuAUThNQCA
InChI InChI=1S/C23H26N2O3S/c1-3-13-25-21(27)19-20(24-22(25)29-15-18(26)28-4-2)17-10-6-5-9-16(17)14-23(19)11-7-8-12-23/h3,5-6,9-10H,1,4,7-8,11-15H2,2H3
InChIKey HDYIMRWACKYCIS-UHFFFAOYSA-N
Mol Weight 410.53 g/mol
Molecular Formula C23H26N2O3S
Exact Mass 410.166414 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7HPexkj7My5
Name ethyl 2-((3-allyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)thio)acetate
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/C23H26N2O3S/c1-3-13-25-21(27)19-20(24-22(25)29-15-18(26)28-4-2)17-10-6-5-9-16(17)14-23(19)11-7-8-12-23/h3,5-6,9-10H,1,4,7-8,11-15H2,2H3
InChIKey HDYIMRWACKYCIS-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_7583
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/10329369