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(2S,4'S,5'R)-2-Amino-4-bromo-1-(3',4'-dimethyl-2'-oxo-5'-phenyl-1'-imidazolyldinyl)-4-penten-1-one
SpectraBase Compound ID DXK2ylCBOGs
InChI InChI=1S/C16H20BrN3O2/c1-10(17)9-13(18)15(21)20-14(11(2)19(3)16(20)22)12-7-5-4-6-8-12/h4-8,11,13-14H,1,9,18H2,2-3H3/t11-,13+,14-/m0/s1
InChIKey JZYLWAOLYVNLAG-YUTCNCBUSA-N
Mol Weight 366.26 g/mol
Molecular Formula C16H20BrN3O2
Exact Mass 365.07389 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Q6ww9KM5SN
Name (2S,4'S,5'R)-2-Amino-4-bromo-1-(3',4'-dimethyl-2'-oxo-5'-phenyl-1'-imidazolyldinyl)-4-penten-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C16H20BrN3O2
InChI InChI=1S/C16H20BrN3O2/c1-10(17)9-13(18)15(21)20-14(11(2)19(3)16(20)22)12-7-5-4-6-8-12/h4-8,11,13-14H,1,9,18H2,2-3H3/t11-,13+,14-/m0/s1
InChIKey JZYLWAOLYVNLAG-YUTCNCBUSA-N
Molecular Weight 366.259 g/mol
SMILES N[C@@](C(N1C(N(C)[C@]([C@]1(c1ccccc1)[H])(C)[H])=O)=O)(CC(=C)Br)[H]
SPLASH splash10-0a4i-9001000000-d18b12fba292186987f5
Source of Spectrum J-65-7319-27
Wiley ID 1533631