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3-(3'-Bromo-4'-methyl-2H-pyran-2'-on-6'-yl)-5-crotonyloxy-2-phenylisoxazolidine
SpectraBase Compound ID I0LrJIrsE4y
InChI InChI=1S/C19H18BrNO5/c1-3-7-16(22)25-17-11-14(15-10-12(2)18(20)19(23)24-15)21(26-17)13-8-5-4-6-9-13/h3-10,14,17H,11H2,1-2H3/b7-3+
InChIKey SEQKBQXVOBFGJW-XVNBXDOJSA-N
Mol Weight 420.26 g/mol
Molecular Formula C19H18BrNO5
Exact Mass 419.036836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6mau1lZVgAq
Name 3-(3'-Bromo-4'-methyl-2H-pyran-2'-on-6'-yl)-5-crotonyloxy-2-phenylisoxazolidine
Comments Less than 3 mono-isotopic peaks
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Formula C19H18BrNO5
InChI InChI=1S/C19H18BrNO5/c1-3-7-16(22)25-17-11-14(15-10-12(2)18(20)19(23)24-15)21(26-17)13-8-5-4-6-9-13/h3-10,14,17H,11H2,1-2H3/b7-3+
InChIKey SEQKBQXVOBFGJW-XVNBXDOJSA-N
Molecular Weight 420.259 g/mol
SMILES C1(N(OC(C1)OC(\C=C\C)=O)c1ccccc1)C=1OC(=O)C(=C(C1)C)Br
SPLASH splash10-014i-9000100000-52fb74f44e88e12abd1d
Source of Spectrum Y-29-929-11
Synonyms 3-(3-bromo-4-methyl-2-oxo-2H-pyran-6-yl)-2-phenyl-5-isoxazolidinyl (2E)-2-butenoate
Wiley ID 1377555