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Benzeneacetic acid, .alpha.-[2-(dimethylamino)-2-oxo-1-phenylethylidene]-, (E)-
SpectraBase Compound ID 4MZLPzzAWJB
InChI InChI=1S/C18H17NO3/c1-19(2)17(20)15(13-9-5-3-6-10-13)16(18(21)22)14-11-7-4-8-12-14/h3-12H,1-2H3,(H,21,22)/b16-15+
InChIKey WUDNXWOPCCMXKP-FOCLMDBBSA-N
Mol Weight 295.34 g/mol
Molecular Formula C18H17NO3
Exact Mass 295.120843 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1uWxOEc0uws
Name Benzeneacetic acid, .alpha.-[2-(dimethylamino)-2-oxo-1-phenylethylidene]-, (E)-
Comments Computed using HOSE algorithm
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Exact Mass 295.120843408 u
Formula C18H17NO3
InChI InChI=1S/C18H17NO3/c1-19(2)17(20)15(13-9-5-3-6-10-13)16(18(21)22)14-11-7-4-8-12-14/h3-12H,1-2H3,(H,21,22)/b16-15+
InChIKey WUDNXWOPCCMXKP-FOCLMDBBSA-N
SMILES C(\C(=C\(C(=O)O)C1=CC=CC=C1)C=1C=CC=CC1)(N(C)C)=O