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6-Formyl-7a-methyl-3-phenyl-7,7a-dihydrobenzo[d]oxazol-2(3H)-one
SpectraBase Compound ID TiKUwimobM
InChI InChI=1S/C15H13NO3/c1-15-9-11(10-17)7-8-13(15)16(14(18)19-15)12-5-3-2-4-6-12/h2-8,10H,9H2,1H3
InChIKey ARCHHKUKUNPSGY-UHFFFAOYSA-N
Mol Weight 255.27 g/mol
Molecular Formula C15H13NO3
Exact Mass 255.089543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2RGlzVyX5sA
Name 6-Formyl-7a-methyl-3-phenyl-7,7a-dihydrobenzo[d]oxazol-2(3H)-one
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 255.089543280 u
Formula C15H13NO3
InChI InChI=1S/C15H13NO3/c1-15-9-11(10-17)7-8-13(15)16(14(18)19-15)12-5-3-2-4-6-12/h2-8,10H,9H2,1H3
InChIKey ARCHHKUKUNPSGY-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 255.273 g/mol
Quality 18
Reported Formula C15H13NO3
SMILES C(=O)C=1CC2(C(N(C(O2)=O)C2=CC=CC=C2)=CC1)C
SPLASH splash10-00lr-0940000000-b3838857e9c9a0292e4e
Source of Spectrum K1-2022-SM17-22a (DOI: 10.1002/ejoc.202200364)
Thin-Layer Chromatography 0.31 (hexane/EtOAc, 7:3)
Wiley ID 1898668