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2,2-Dimethyl-4,7-diphenyl-3,4-dihydro-1,3,4,6-oxatriazepine-5(2H)-thione
SpectraBase Compound ID IGue0re22z2
InChI InChI=1S/C17H17N3OS/c1-17(2)19-20(14-11-7-4-8-12-14)16(22)18-15(21-17)13-9-5-3-6-10-13/h3-12,19H,1-2H3
InChIKey UPTRRKNBFPSKOV-UHFFFAOYSA-N
Mol Weight 311.4 g/mol
Molecular Formula C17H17N3OS
Exact Mass 311.109233 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BMyoJn7QqlX
Name 2,2-Dimethyl-4,7-diphenyl-3,4-dihydro-1,3,4,6-oxatriazepine-5(2H)-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17N3OS
InChI InChI=1S/C17H17N3OS/c1-17(2)19-20(14-11-7-4-8-12-14)16(22)18-15(21-17)13-9-5-3-6-10-13/h3-12,19H,1-2H3
InChIKey UPTRRKNBFPSKOV-UHFFFAOYSA-N
Molecular Weight 311.403 g/mol
SMILES N1C(OC(=NC(N1c1ccccc1)=S)c1ccccc1)(C)C
SPLASH splash10-0a6s-9710000000-cc0d78059e83ed93d009
Synonyms 2,2-Dimethyl-4,7-diphenyl-3H-1,3,4,6-oxatriazepine-5-thione 2H-[1,3,4,6]Oxatriazepine-5-thione, 2,2-dimethyl-4,7-diphenyl-3,4-dihydro-
Wiley ID 1439316