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1-[(2E)-2-[2-(4-chlorophenyl)-2-keto-ethylidene]hexahydropyrimidin-1-yl]propan-1-one
SpectraBase Compound ID 7bVPKIRs3Kb
InChI InChI=1S/C15H17ClN2O2/c1-2-15(20)18-9-3-8-17-14(18)10-13(19)11-4-6-12(16)7-5-11/h4-7,10,17H,2-3,8-9H2,1H3/b14-10+
InChIKey JTONOAZSPCTHIT-GXDHUFHOSA-N
Mol Weight 292.77 g/mol
Molecular Formula C15H17ClN2O2
Exact Mass 292.097855 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DoDtcYfiQKb
Name 1-[(2E)-2-[2-(4-chlorophenyl)-2-keto-ethylidene]hexahydropyrimidin-1-yl]propan-1-one
Alternate Name(s) 1-[(2E)-2-[2-(4-chlorophenyl)-2-oxidanylidene-ethylidene]-1,3-diazinan-1-yl]propan-1-one 1-[(2E)-2-[2-(4-chlorophenyl)-2-oxo-ethylidene]hexahydropyrimidin-1-yl]propan-1-one 1-[(2E)-2-[2-(4-chlorophenyl)-2-oxoethylidene]-1,3-diazinan-1-yl]-1-propanone 1-[(2E)-2-[2-(4-chlorophenyl)-2-oxoethylidene]-1,3-diazinan-1-yl]propan-1-one
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Formula C15H17ClN2O2
InChI InChI=1S/C15H17ClN2O2/c1-2-15(20)18-9-3-8-17-14(18)10-13(19)11-4-6-12(16)7-5-11/h4-7,10,17H,2-3,8-9H2,1H3/b14-10+
InChIKey JTONOAZSPCTHIT-GXDHUFHOSA-N
Molecular Weight 292.766 g/mol
SMILES N1CCCN(\C1=C/C(c1ccc(cc1)Cl)=O)C(=O)CC
SPLASH splash10-052u-0290000000-e4e257eab6d72ef2e1f4
Source of Spectrum SK-26-2292-6
Wiley ID 867155