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3-Phenyl-4-(phenylethynyl)-1H-[1,3]oxazino[3,4-a]indol-1-one
SpectraBase Compound ID AFejGrt9aCy
InChI InChI=1S/C25H15NO2/c27-25-26-22-14-8-7-13-20(22)17-23(26)21(16-15-18-9-3-1-4-10-18)24(28-25)19-11-5-2-6-12-19/h1-14,17H
InChIKey MJBIUWPNHILAFQ-UHFFFAOYSA-N
Mol Weight 361.4 g/mol
Molecular Formula C25H15NO2
Exact Mass 361.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 21DvQ1pQ2a
Name 3-Phenyl-4-(phenylethynyl)-1H-[1,3]oxazino[3,4-a]indol-1-one
Appearance Yellow solid
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Formula C25H15NO2
InChI InChI=1S/C25H15NO2/c27-25-26-22-14-8-7-13-20(22)17-23(26)21(16-15-18-9-3-1-4-10-18)24(28-25)19-11-5-2-6-12-19/h1-14,17H
InChIKey MJBIUWPNHILAFQ-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.202202847
Molecular Weight 361.400 g/mol
Quality 113
Reported Formula C25H15NO2
SMILES C1(=CC=CC=C1)C1=C(C=2N(C3=C(C2)C=CC=C3)C(O1)=O)C#CC1=CC=CC=C1
SPLASH splash10-06vi-8918000000-31e4b1aff8bf987ce118
Source of Spectrum QE-29-SM28-5a (DOI: 10.1002/chem.202202847)
Wiley ID 1909523