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1-(3'-(4-nitrophenyl)-3,3-di-p-tolyl-3H,3'H-spiro[benzo[c]thiophene-1,2'-[1,3,4]thiadiazol]-5'-yl)ethanone
SpectraBase Compound ID 47TkVLAgfSd
InChI InChI=1S/C31H25N3O3S2/c1-20-8-12-23(13-9-20)30(24-14-10-21(2)11-15-24)27-6-4-5-7-28(27)31(39-30)33(32-29(38-31)22(3)35)25-16-18-26(19-17-25)34(36)37/h4-19H,1-3H3
InChIKey MPNWBVUYHIRPHZ-UHFFFAOYSA-N
Mol Weight 551.68 g/mol
Molecular Formula C31H25N3O3S2
Exact Mass 551.133734 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 35cK83JgKsF
Name 1-(3'-(4-nitrophenyl)-3,3-di-p-tolyl-3H,3'H-spiro[benzo[c]thiophene-1,2'-[1,3,4]thiadiazol]-5'-yl)ethanone
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/C31H25N3O3S2/c1-20-8-12-23(13-9-20)30(24-14-10-21(2)11-15-24)27-6-4-5-7-28(27)31(39-30)33(32-29(38-31)22(3)35)25-16-18-26(19-17-25)34(36)37/h4-19H,1-3H3
InChIKey MPNWBVUYHIRPHZ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_5695
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: 122784; Labnumber: SPGAL-0159; VK_ID: VK-005698
Temperature 318 °C