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6-tert-Butyl-2,4-diphenyl-1,2,4,5-tetrazinane-3-thione

View entire compound with spectra: 1 MS (GC)

6-tert-Butyl-2,4-diphenyl-1,2,4,5-tetrazinane-3-thione
SpectraBase Compound ID Aepn9r99pUa
InChI InChI=1S/C18H22N4S/c1-18(2,3)16-19-21(14-10-6-4-7-11-14)17(23)22(20-16)15-12-8-5-9-13-15/h4-13,16,19-20H,1-3H3
InChIKey IUKAIUYGKKHECB-UHFFFAOYSA-N
Mol Weight 326.46 g/mol
Molecular Formula C18H22N4S
Exact Mass 326.156518 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KxjeSyEcekh
Name 6-tert-Butyl-2,4-diphenyl-1,2,4,5-tetrazinane-3-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22N4S
InChI InChI=1S/C18H22N4S/c1-18(2,3)16-19-21(14-10-6-4-7-11-14)17(23)22(20-16)15-12-8-5-9-13-15/h4-13,16,19-20H,1-3H3
InChIKey IUKAIUYGKKHECB-UHFFFAOYSA-N
Molecular Weight 326.462 g/mol
SMILES N1C(NN(C(N1c1ccccc1)=S)c1ccccc1)C(C)(C)C
SPLASH splash10-014i-2090000000-ccc7eff3e7f20dc12aba
Source of Spectrum KC-0-543-7
Wiley ID 820988