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ethyl 3'-(4-bromophenyl)-3,3-bis(4-chlorophenyl)-3H,3'H-spiro[benzo[c]thiophene-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
SpectraBase Compound ID 1gJb2LFNYjZ
InChI InChI=1S/C30H21BrCl2N2O2S2/c1-2-37-28(36)27-34-35(24-17-11-21(31)12-18-24)30(38-27)26-6-4-3-5-25(26)29(39-30,19-7-13-22(32)14-8-19)20-9-15-23(33)16-10-20/h3-18H,2H2,1H3
InChIKey FVIBIUPMIPDBRZ-UHFFFAOYSA-N
Mol Weight 656.44 g/mol
Molecular Formula C30H21BrCl2N2O2S2
Exact Mass 653.960489 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CWzVQTcgJZ3
Name ethyl 3'-(4-bromophenyl)-3,3-bis(4-chlorophenyl)-3H,3'H-spiro[benzo[c]thiophene-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
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/C30H21BrCl2N2O2S2/c1-2-37-28(36)27-34-35(24-17-11-21(31)12-18-24)30(38-27)26-6-4-3-5-25(26)29(39-30,19-7-13-22(32)14-8-19)20-9-15-23(33)16-10-20/h3-18H,2H2,1H3
InChIKey FVIBIUPMIPDBRZ-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4984
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: E12674; Labnumber: SPGAL-0399; SBI_ID: SBI-004986
Temperature 306 °C