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6-Methyl-2H-1,4-benzoxazin-3(4H)-one
SpectraBase Compound ID GY9EFTb8KbB
InChI InChI=1S/C9H9NO2/c1-6-2-3-8-7(4-6)10-9(11)5-12-8/h2-4H,5H2,1H3,(H,10,11)
InChIKey JSBZPNRRLJLZBE-UHFFFAOYSA-N
Mol Weight 163.18 g/mol
Molecular Formula C9H9NO2
Exact Mass 163.063329 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID JIoyYsWg2yh
Name 6-Methyl-2H-1,4-benzoxazin-3(4H)-one
Source of Sample Sigma-Aldrich Company LLC
Catalog Number 475467
Lot Number 08823AEV
CAS Registry Number 39522-26-4
Cell Type NMR tube
Compound Type Pure
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Formula C9H9NO2
InChI InChI=1S/C9H9NO2/c1-6-2-3-8-7(4-6)10-9(11)5-12-8/h2-4H,5H2,1H3,(H,10,11)
InChIKey JSBZPNRRLJLZBE-UHFFFAOYSA-N
Raman Corrections Referenced to internal white light source; 180 degree backscatter
Raman Laser Power 1002 mW
Raman Laser Source Nd:YAG
SMILES N1C(COc2ccc(cc12)C)=O
Scans Performed 1280
Source of Spectrum Forensic Spectral Research
Technique FT-Raman