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2-phenyl-4H-3,1-benzoxazin-4-one

View entire compound with spectra: 8 NMR, 3 FTIR, and 15 MS (GC)

2-phenyl-4H-3,1-benzoxazin-4-one
SpectraBase Compound ID I77cHDbrajp
InChI InChI=1S/C14H9NO2/c16-14-11-8-4-5-9-12(11)15-13(17-14)10-6-2-1-3-7-10/h1-9H
InChIKey HTTLBYITFHMYFK-UHFFFAOYSA-N
Mol Weight 223.23 g/mol
Molecular Formula C14H9NO2
Exact Mass 223.063329 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GXyXjPxEtSY
Name BENTRANIL
CAS Registry Number 1022-46-4
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 223.063328532 u
Formula C14H9NO2
InChI InChI=1S/C14H9NO2/c16-14-11-8-4-5-9-12(11)15-13(17-14)10-6-2-1-3-7-10/h1-9H
InChIKey HTTLBYITFHMYFK-UHFFFAOYSA-N
Molecular Weight 223.231 g/mol
Nominal Mass 223 u
Number of Peaks 70
SMILES c1ccc(cc1)C1=Nc2ccccc2C(=O)O1
SPLASH splash10-05di-9840000000-d52cd1477608a615947b
Source of Spectrum Dr. Rolf Kuehnle
Synonyms 2-phenyl-4H-3,1-benzoxazin-4-one
Technique GC/MS
Wiley ID WID_MSPA_3741