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3-(4-bromophenyl)-1-(4-methylbenzoyl)-1,4-diazaspiro[4.6]undec-3-ene-2-thione
SpectraBase Compound ID 1Rkml9Dp5Ky
InChI InChI=1S/C23H23BrN2OS/c1-16-6-8-18(9-7-16)21(27)26-22(28)20(17-10-12-19(24)13-11-17)25-23(26)14-4-2-3-5-15-23/h6-13H,2-5,14-15H2,1H3
InChIKey PEJDHRLEXYMPAX-UHFFFAOYSA-N
Mol Weight 455.41 g/mol
Molecular Formula C23H23BrN2OS
Exact Mass 454.071448 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JarNmezRoMV
Name 3-(4-bromophenyl)-1-(4-methylbenzoyl)-1,4-diazaspiro[4.6]undec-3-ene-2-thione
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 454.071447542 u
Formula C23H23BrN2OS
InChI InChI=1S/C23H23BrN2OS/c1-16-6-8-18(9-7-16)21(27)26-22(28)20(17-10-12-19(24)13-11-17)25-23(26)14-4-2-3-5-15-23/h6-13H,2-5,14-15H2,1H3
InChIKey PEJDHRLEXYMPAX-UHFFFAOYSA-N
Molecular Weight 455.414 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_6786
Solvent DMSO-d6
Source Vendor ID: NMR/12329138