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1-[8-(4-isopropylphenyl)-1-(3-nitrophenyl)-6-phenyl-4-thia-1,2,6,7-tetraazaspiro[4.5]deca-2,7-dien-3-yl]ethanone
SpectraBase Compound ID 5gOM0T6Es0H
InChI InChI=1S/C28H27N5O3S/c1-19(2)21-12-14-22(15-13-21)26-16-17-28(31(29-26)23-8-5-4-6-9-23)32(30-27(37-28)20(3)34)24-10-7-11-25(18-24)33(35)36/h4-15,18-19H,16-17H2,1-3H3
InChIKey MKNSIIRBWFEISX-UHFFFAOYSA-N
Mol Weight 513.62 g/mol
Molecular Formula C28H27N5O3S
Exact Mass 513.183461 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6A54CAxyrIe
Name 1-[8-(4-isopropylphenyl)-1-(3-nitrophenyl)-6-phenyl-4-thia-1,2,6,7-tetraazaspiro[4.5]deca-2,7-dien-3-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/C28H27N5O3S/c1-19(2)21-12-14-22(15-13-21)26-16-17-28(31(29-26)23-8-5-4-6-9-23)32(30-27(37-28)20(3)34)24-10-7-11-25(18-24)33(35)36/h4-15,18-19H,16-17H2,1-3H3
InChIKey MKNSIIRBWFEISX-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_10672
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: 135388; Labnumber: SPGAL3-0070; VK_ID: VK-010676
Temperature 318 °C