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6-Formyl-7a-methyl-3-(p-tolyl)-7,7a-dihydrobenzo[d]oxazol-2(3H)-one
SpectraBase Compound ID 4RGFnSAipw0
InChI InChI=1S/C16H15NO3/c1-11-3-6-13(7-4-11)17-14-8-5-12(10-18)9-16(14,2)20-15(17)19/h3-8,10H,9H2,1-2H3
InChIKey TVKFCSFSQMWTED-UHFFFAOYSA-N
Mol Weight 269.3 g/mol
Molecular Formula C16H15NO3
Exact Mass 269.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 96tPXvuxURB
Name 6-Formyl-7a-methyl-3-(p-tolyl)-7,7a-dihydrobenzo[d]oxazol-2(3H)-one
Appearance Yellow solid
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Formula C16H15NO3
InChI InChI=1S/C16H15NO3/c1-11-3-6-13(7-4-11)17-14-8-5-12(10-18)9-16(14,2)20-15(17)19/h3-8,10H,9H2,1-2H3
InChIKey TVKFCSFSQMWTED-UHFFFAOYSA-N
Instrument Name Thermo Polaris Q-Trace GC Ultra or Hewlett-Packard 5971A
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202200364
Molecular Weight 269.300 g/mol
Quality 151
Reported Formula C16H15NO3
SMILES C(=O)C=1CC2(C(N(C(O2)=O)C2=CC=C(C=C2)C)=CC1)C
SPLASH splash10-000t-0910000000-bb79b3b7d52527add9ca
Source of Spectrum K1-2022-SM18-22c (DOI: 10.1002/ejoc.202200364)
Thin-Layer Chromatography 0.34 (hexane/EtOAc, 7:3)
Wiley ID 1898669