For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-(3-bromophenyl)-2-((2-methylallyl)thio)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
SpectraBase Compound ID AiYMD7Jgs80
InChI InChI=1S/C27H27BrN2OS/c1-18(2)17-32-26-29-24-22-12-5-4-9-19(22)16-27(13-6-3-7-14-27)23(24)25(31)30(26)21-11-8-10-20(28)15-21/h4-5,8-12,15H,1,3,6-7,13-14,16-17H2,2H3
InChIKey BIYMGAGDUXHAOM-UHFFFAOYSA-N
Mol Weight 507.49 g/mol
Molecular Formula C27H27BrN2OS
Exact Mass 506.102748 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9i0mh3PDS71
Name 3-(3-bromophenyl)-2-((2-methylallyl)thio)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C27H27BrN2OS/c1-18(2)17-32-26-29-24-22-12-5-4-9-19(22)16-27(13-6-3-7-14-27)23(24)25(31)30(26)21-11-8-10-20(28)15-21/h4-5,8-12,15H,1,3,6-7,13-14,16-17H2,2H3
InChIKey BIYMGAGDUXHAOM-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_3479
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: 112197; Labnumber: AMIR-4524; VK_ID: VK-003480
Temperature 308 °C