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dimethyl 1-(4-bromophenyl)-8-methyl-9-phenyl-4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene-3,7-dicarboxylate
SpectraBase Compound ID KeH1PuRu8Ia
InChI InChI=1S/C21H18BrN3O4S2/c1-13-17(19(26)28-2)30-21(24(13)15-7-5-4-6-8-15)25(16-11-9-14(22)10-12-16)23-18(31-21)20(27)29-3/h4-12H,1-3H3
InChIKey UNRMNYOCVUPXQL-UHFFFAOYSA-N
Mol Weight 520.42 g/mol
Molecular Formula C21H18BrN3O4S2
Exact Mass 518.992211 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8ABQ3masGBf
Name dimethyl 1-(4-bromophenyl)-8-methyl-9-phenyl-4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene-3,7-dicarboxylate
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/C21H18BrN3O4S2/c1-13-17(19(26)28-2)30-21(24(13)15-7-5-4-6-8-15)25(16-11-9-14(22)10-12-16)23-18(31-21)20(27)29-3/h4-12H,1-3H3
InChIKey UNRMNYOCVUPXQL-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_24289
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: D46406; Labnumber: SPGAL3-0895; SBI_ID: SBI-024293
Temperature 303 °C