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(Z)-2-Bromomethyl-3-(5-methoxy-2-p tolyloxy-phenyl)-acrylic acid methyl ester
SpectraBase Compound ID 6RRDu1Ku4o5
InChI InChI=1S/C19H19BrO4/c1-13-4-6-16(7-5-13)24-18-9-8-17(22-2)11-14(18)10-15(12-20)19(21)23-3/h4-11H,12H2,1-3H3/b15-10+
InChIKey BRHNIEGLTHKFRV-XNTDXEJSSA-N
Mol Weight 391.26 g/mol
Molecular Formula C19H19BrO4
Exact Mass 390.046672 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID xe47LeXG90
Name (Z)-2-Bromomethyl-3-(5-methoxy-2-p tolyloxy-phenyl)-acrylic acid methyl ester
Comments Computed using HOSE algorithm
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Exact Mass 390.046672088 u
Formula C19H19BrO4
InChI InChI=1S/C19H19BrO4/c1-13-4-6-16(7-5-13)24-18-9-8-17(22-2)11-14(18)10-15(12-20)19(21)23-3/h4-11H,12H2,1-3H3/b15-10+
InChIKey BRHNIEGLTHKFRV-XNTDXEJSSA-N
Molecular Weight 391.261 g/mol
SMILES C=1(\C=C\(C(=O)OC)CBr)C(OC2=CC=C(C=C2)C)=CC=C(C1)OC