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6-Phenyl-1,3-dimethyl-2,4-dioxo-1,2,3,4,8,9-hexahydro[1,3,5]thiadiazepino[3,2-f]purine
SpectraBase Compound ID 7VC9RPkutAD
InChI InChI=1S/C16H15N5O2S/c1-19-13-11(14(22)20(2)16(19)23)21-12(10-6-4-3-5-7-10)17-8-9-24-15(21)18-13/h3-7H,8-9H2,1-2H3
InChIKey YUEDPPOXCVTWIG-UHFFFAOYSA-N
Mol Weight 341.39 g/mol
Molecular Formula C16H15N5O2S
Exact Mass 341.094646 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L1mufdYhjxx
Name 6-Phenyl-1,3-dimethyl-2,4-dioxo-1,2,3,4,8,9-hexahydro[1,3,5]thiadiazepino[3,2-f]purine
Alternate Name(s) 1,3-Dimethyl-6-phenyl-8,9-dihydropurino[8,7-b][1,3,5]thiadiazepine-2,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15N5O2S
InChI InChI=1S/C16H15N5O2S/c1-19-13-11(14(22)20(2)16(19)23)21-12(10-6-4-3-5-7-10)17-8-9-24-15(21)18-13/h3-7H,8-9H2,1-2H3
InChIKey YUEDPPOXCVTWIG-UHFFFAOYSA-N
Molecular Weight 341.389 g/mol
SMILES c12[n]3c(nc2N(C)C(N(C1=O)C)=O)SCCN=C3c1ccccc1
SPLASH splash10-0f76-0897000000-cf8e6aeccbc69f137e39
Source of Spectrum AH-125-1277-5
Wiley ID 1335791