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4-METHYL-(PARA-METHYLBENZYL)-2H-1,4-BENZOXAZIN-3-ONE

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4-METHYL-(PARA-METHYLBENZYL)-2H-1,4-BENZOXAZIN-3-ONE
SpectraBase Compound ID FTt1Em5qM3n
InChI InChI=1S/C17H15NO3/c1-12-6-8-13(9-7-12)15(19)10-18-14-4-2-3-5-16(14)21-11-17(18)20/h2-9H,10-11H2,1H3
InChIKey CLNLUFQHPGUWBR-UHFFFAOYSA-N
Mol Weight 281.31 g/mol
Molecular Formula C17H15NO3
Exact Mass 281.105193 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BtJdDQB3rII
Name 4-(4-Methyl-phenacyl)-2H-1,4-benzoxazin-3-one
CAS Registry Number 105492-44-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H15NO3
InChI InChI=1S/C17H15NO3/c1-12-6-8-13(9-7-12)15(19)10-18-14-4-2-3-5-16(14)21-11-17(18)20/h2-9H,10-11H2,1H3
InChIKey CLNLUFQHPGUWBR-UHFFFAOYSA-N
Instrument Name Jeol FX-100
Literature Reference K.V. Rao, P.S. Reddy, V. Sundaramurthy, Magn. Res. Chem. 24, 644 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3