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4-(Butylselanyl)-3-(4-chlorophenyl)-1H-[1,3]oxazino[3,4-a]indol-1-one
SpectraBase Compound ID JsMleIJjuDY
InChI InChI=1S/C21H18ClNO2Se/c1-2-3-12-26-20-18-13-15-6-4-5-7-17(15)23(18)21(24)25-19(20)14-8-10-16(22)11-9-14/h4-11,13H,2-3,12H2,1H3
InChIKey ZRASUTAMZONNOP-UHFFFAOYSA-N
Mol Weight 430.8 g/mol
Molecular Formula C21H18ClNO2Se
Exact Mass 431.019129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7cQRMDOya38
Name 4-(Butylselanyl)-3-(4-chlorophenyl)-1H-[1,3]oxazino[3,4-a]indol-1-one
Appearance Yellow solid
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Exact Mass 431.019128522 u
Formula C21H18ClNO2Se
InChI InChI=1S/C21H18ClNO2Se/c1-2-3-12-26-20-18-13-15-6-4-5-7-17(15)23(18)21(24)25-19(20)14-8-10-16(22)11-9-14/h4-11,13H,2-3,12H2,1H3
InChIKey ZRASUTAMZONNOP-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.202202847
Molecular Weight 430.805 g/mol
Quality 76
Reported Formula C21H18ClNO2Se
SMILES C(CCC)[Se]C1=C(OC(N2C1=CC1=C2C=CC=C1)=O)C1=CC=C(C=C1)Cl
SPLASH splash10-01ti-1902100000-89135a305800f4fbfd9e
Source of Spectrum QE-29-SM24-2l (DOI: 10.1002/chem.202202847)
Wiley ID 1909512