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L-3-Acetyl-5-benzyl-1-phenyl-4,5-dihydro-1,2,4-triazin-6-one oxime
SpectraBase Compound ID BzbqkNEmBau
InChI InChI=1S/C18H18N4O2/c1-13(21-24)17-19-16(12-14-8-4-2-5-9-14)18(23)22(20-17)15-10-6-3-7-11-15/h2-11,16,24H,12H2,1H3,(H,19,20)/b21-13+/t16-/m0/s1
InChIKey UDFFTBGYXNQVET-REIAIGDLSA-N
Mol Weight 322.37 g/mol
Molecular Formula C18H18N4O2
Exact Mass 322.142976 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6HOMJ48m29d
Name L-3-Acetyl-5-benzyl-1-phenyl-4,5-dihydro-1,2,4-triazin-6-one oxime
Alternate Name(s) (6Z)-3-acetyl-5-benzyl-1-phenyl-4,5-dihydro-1,2,4-triazin-6(1H)-one oxime (S)-5-Benzyl-3-(1-hydroxyimino-ethyl)-1-phenyl-4,5-dihydro-1H-[1,2,4]triazin-6-one D-3-Acetyl-5-benzyl-1-phenyl-4,5-dihydro-1,2,4-triazin-6-one oxime
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Formula C18H18N4O2
InChI InChI=1S/C18H18N4O2/c1-13(21-24)17-19-16(12-14-8-4-2-5-9-14)18(23)22(20-17)15-10-6-3-7-11-15/h2-11,16,24H,12H2,1H3,(H,19,20)/b21-13+/t16-/m0/s1
InChIKey UDFFTBGYXNQVET-REIAIGDLSA-N
Molecular Weight 322.368 g/mol
SMILES N1[C@](C(N(N=C1\C(=N\O)C)c1ccccc1)=O)(Cc1ccccc1)[H]
SPLASH splash10-001i-4191000000-d14aa5f557ada40e5bef
Source of Spectrum H1-53-1743-2
Wiley ID 817905