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ethyl 2-((3-cyclohexyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)thio)acetate
SpectraBase Compound ID 6JCOtWAtieJ
InChI InChI=1S/C26H32N2O3S/c1-2-31-21(29)17-32-25-27-23-20-13-7-6-10-18(20)16-26(14-8-9-15-26)22(23)24(30)28(25)19-11-4-3-5-12-19/h6-7,10,13,19H,2-5,8-9,11-12,14-17H2,1H3
InChIKey ZWAHAAGZIXEPBK-UHFFFAOYSA-N
Mol Weight 452.6 g/mol
Molecular Formula C26H32N2O3S
Exact Mass 452.213364 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Cf9YDqFjmjf
Name ethyl 2-((3-cyclohexyl-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/C26H32N2O3S/c1-2-31-21(29)17-32-25-27-23-20-13-7-6-10-18(20)16-26(14-8-9-15-26)22(23)24(30)28(25)19-11-4-3-5-12-19/h6-7,10,13,19H,2-5,8-9,11-12,14-17H2,1H3
InChIKey ZWAHAAGZIXEPBK-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_7188
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/12238480