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6-Deuterio-6-(2,3,4,5,6-pentadeuteriophenyl)-2,4-diphenyl-1,2,4,5-tetrazinane-3-thione
SpectraBase Compound ID JcUuV5XVlXm
InChI InChI=1S/C20H18N4S/c25-20-23(17-12-6-2-7-13-17)21-19(16-10-4-1-5-11-16)22-24(20)18-14-8-3-9-15-18/h1-15,19,21-22H/i1D,4D,5D,10D,11D,19D
InChIKey STAULNQNGOBAEU-MLRCEUCDSA-N
Mol Weight 352.49 g/mol
Molecular Formula C20H12D6N4S
Exact Mass 352.162878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DQKYa8jy8Wj
Name 6-Deuterio-6-(2,3,4,5,6-pentadeuteriophenyl)-2,4-diphenyl-1,2,4,5-tetrazinane-3-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H12D6N4S
InChI InChI=1S/C20H18N4S/c25-20-23(17-12-6-2-7-13-17)21-19(16-10-4-1-5-11-16)22-24(20)18-14-8-3-9-15-18/h1-15,19,21-22H/i1D,4D,5D,10D,11D,19D
InChIKey STAULNQNGOBAEU-MLRCEUCDSA-N
Molecular Weight 352.489 g/mol
SMILES N1C(c2c(c([D])c(c(c2[D])[D])[D])[D])(NN(c2ccccc2)C(N1c1ccccc1)=S)[D]
SPLASH splash10-0fb9-8915000000-d1a7c65783ac2c75308e
Source of Spectrum KC-0-542-7
Wiley ID 820991