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6-Formyl-7a-methyl-3-(4-methoxyphenyl)-7,7a-dihydrobenzo[d]oxazol-2(3H)-one
SpectraBase Compound ID 6zpJYc54nI6
InChI InChI=1S/C16H15NO4/c1-16-9-11(10-18)3-8-14(16)17(15(19)21-16)12-4-6-13(20-2)7-5-12/h3-8,10H,9H2,1-2H3
InChIKey VCUFCJBSGVNNTE-UHFFFAOYSA-N
Mol Weight 285.3 g/mol
Molecular Formula C16H15NO4
Exact Mass 285.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6LnJCf8uAkY
Name 6-Formyl-7a-methyl-3-(4-methoxyphenyl)-7,7a-dihydrobenzo[d]oxazol-2(3H)-one
Appearance Pale-yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15NO4
InChI InChI=1S/C16H15NO4/c1-16-9-11(10-18)3-8-14(16)17(15(19)21-16)12-4-6-13(20-2)7-5-12/h3-8,10H,9H2,1-2H3
InChIKey VCUFCJBSGVNNTE-UHFFFAOYSA-N
Instrument Name Thermo Polaris Q-Trace GC Ultra or Hewlett-Packard 5971A
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202200364
Quality 45
Reported Formula C16H15NO4
SMILES C(=O)C=1CC2(C(N(C(O2)=O)C2=CC=C(C=C2)OC)=CC1)C
SPLASH splash10-03e9-0890000000-af30a457d99508f39713
Source of Spectrum K1-2022-SM19-22e (DOI: 10.1002/ejoc.202200364)
Thin-Layer Chromatography 0.23 (hexane/EtOAc, 7:3)
Wiley ID 1898671