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Spiro[2-phenyl-7-methyl-6,8-dioxo-3,7-diazabicyclo[3.3.0]octae-5,5'-barbituryl]
SpectraBase Compound ID CStfoUYeqy3
InChI InChI=1S/C16H14N4O5/c1-20-11(21)8-9(12(20)22)16(13(23)17-15(25)18-14(16)24)19-10(8)7-5-3-2-4-6-7/h2-6,8-10,19H,1H3,(H2,17,18,23,24,25)/t8-,9?,10-/m1/s1
InChIKey MEUDSUSHEZFNAV-RCAUJQPQSA-N
Mol Weight 342.31 g/mol
Molecular Formula C16H14N4O5
Exact Mass 342.09642 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1R9vm6x0dt
Name Spiro[2-phenyl-7-methyl-6,8-dioxo-3,7-diazabicyclo[3.3.0]octae-5,5'-barbituryl]
Alternate Name(s) (3'S,3'aR)-5'-methyl-3'-phenyl-hexahydro-2'H-spiro[1,5-diazinane-3,1'-pyrrolo[3,4-c]pyrrole]-2,4,4',6,6'-pentone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14N4O5
InChI InChI=1S/C16H14N4O5/c1-20-11(21)8-9(12(20)22)16(13(23)17-15(25)18-14(16)24)19-10(8)7-5-3-2-4-6-7/h2-6,8-10,19H,1H3,(H2,17,18,23,24,25)/t8-,9?,10-/m1/s1
InChIKey MEUDSUSHEZFNAV-RCAUJQPQSA-N
Molecular Weight 342.311 g/mol
SMILES N1[C@@]([C@]2(C(C11C(NC(=O)NC1=O)=O)C(N(C2=O)C)=O)[H])(c1ccccc1)[H]
SPLASH splash10-03e9-0490000000-de77a809528333a8ff3d
Source of Spectrum F-50-901-9
Wiley ID 1336319