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2-(2-iodanyl-3-methoxy-phenyl)-4,4-dimethyl-5H-1,3-oxazole
SpectraBase Compound ID ppjaCb0aJh
InChI InChI=1S/C12H14INO2/c1-12(2)7-16-11(14-12)8-5-4-6-9(15-3)10(8)13/h4-6H,7H2,1-3H3
InChIKey OVHKRTMOVCLNRB-UHFFFAOYSA-N
Mol Weight 331.15 g/mol
Molecular Formula C12H14INO2
Exact Mass 331.006924 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ji4HDaupW
Name 2-(2-Iodo-3-methoxyphenyl)-4,4-dimethyl-4,5-dihydrooxazole
Appearance Yellow solid
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Exact Mass 331.006923693 u
Formula C12H14INO2
InChI InChI=1S/C12H14INO2/c1-12(2)7-16-11(14-12)8-5-4-6-9(15-3)10(8)13/h4-6H,7H2,1-3H3
InChIKey OVHKRTMOVCLNRB-UHFFFAOYSA-N
Instrument Name FINNIGAN MAT 95Q or HEWLETT-PACKARD HP 6890-MSD 5973
Ionization Type EI
Literature Reference DOI 10.1002/chem.202103700
Molecular Weight 331.153 g/mol
Quality 207
Reported Formula C12H14INO2
SMILES C1=C(C(=C(C=C1)OC)I)C=1OCC(N1)(C)C
SPLASH splash10-067i-0639000000-c67caa06b40cb58031d0
Source of Spectrum QE-28-SM34-2o (DOI: 10.1002/chem.202103700)
Wiley ID 1898217