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5(4H)-Oxazolone, 4-[[3-iodo-5-methoxy-4-(1-methylethoxy)phenyl]methylidene]-2-(4-methoxyphenyl)-
SpectraBase Compound ID CdhsF0VD3qI
InChI InChI=1S/C21H20INO5/c1-12(2)27-19-16(22)9-13(11-18(19)26-4)10-17-21(24)28-20(23-17)14-5-7-15(25-3)8-6-14/h5-12H,1-4H3/b17-10+
InChIKey ATTJVCLWYYPEPM-LICLKQGHSA-N
Mol Weight 493.3 g/mol
Molecular Formula C21H20INO5
Exact Mass 493.038618 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GJeZ8Ps2dCG
Name 5(4H)-Oxazolone, 4-[[3-iodo-5-methoxy-4-(1-methylethoxy)phenyl]methylidene]-2-(4-methoxyphenyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20INO5
InChI InChI=1S/C21H20INO5/c1-12(2)27-19-16(22)9-13(11-18(19)26-4)10-17-21(24)28-20(23-17)14-5-7-15(25-3)8-6-14/h5-12H,1-4H3/b17-10+
InChIKey ATTJVCLWYYPEPM-LICLKQGHSA-N
Molecular Weight 493.297 g/mol
SMILES C=1(OC(\C(N1)=C/c1cc(c(c(c1)OC)OC(C)C)I)=O)c1ccc(cc1)OC
SPLASH splash10-000i-5900200000-ba919980b1788d21e94f
Source of Spectrum IY-1-4678-1
Synonyms (4E)-4-[(3-iodo-5-methoxy-4-propan-2-yloxyphenyl)methylidene]-2-(4-methoxyphenyl)-5-oxazolone (4E)-4-[(3-iodo-5-methoxy-4-propan-2-yloxyphenyl)methylidene]-2-(4-methoxyphenyl)-1,3-oxazol-5-one (4E)-4-[(3-iodo-4-isopropoxy-5-methoxy-phenyl)methylene]-2-(4-methoxyphenyl)oxazol-5-one (4E)-4-[(3-iodanyl-5-methoxy-4-propan-2-yloxy-phenyl)methylidene]-2-(4-methoxyphenyl)-1,3-oxazol-5-one
Wiley ID 1654764