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4-(Butylselanyl)-3-(4-methoxyphenyl)-1H-[1,3]oxazino[3,4-a]indol-1-one
SpectraBase Compound ID KIhp7josgxZ
InChI InChI=1S/C22H21NO3Se/c1-3-4-13-27-21-19-14-16-7-5-6-8-18(16)23(19)22(24)26-20(21)15-9-11-17(25-2)12-10-15/h5-12,14H,3-4,13H2,1-2H3
InChIKey YFOXKSAQIYKUKP-UHFFFAOYSA-N
Mol Weight 426.39 g/mol
Molecular Formula C22H21NO3Se
Exact Mass 427.068666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KD6uu8zh4Q0
Name 4-(Butylselanyl)-3-(4-methoxyphenyl)-1H-[1,3]oxazino[3,4-a]indol-1-one
Appearance Light brown solid
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Exact Mass 427.068665537 u
Formula C22H21NO3Se
InChI InChI=1S/C22H21NO3Se/c1-3-4-13-27-21-19-14-16-7-5-6-8-18(16)23(19)22(24)26-20(21)15-9-11-17(25-2)12-10-15/h5-12,14H,3-4,13H2,1-2H3
InChIKey YFOXKSAQIYKUKP-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.202202847
Molecular Weight 426.386 g/mol
Quality 69
Reported Formula C22H21NO3Se
SMILES C(CCC)[Se]C1=C(OC(N2C1=CC1=C2C=CC=C1)=O)C1=CC=C(C=C1)OC
SPLASH splash10-004r-5962200000-b45be710737fc5307254
Source of Spectrum QE-29-SM24-2m (DOI: 10.1002/chem.202202847)
Wiley ID 1909513