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Etifoxine
SpectraBase Compound ID 6ykW2O90n1F
InChI InChI=1S/C17H17ClN2O/c1-3-19-16-20-15-10-9-13(18)11-14(15)17(2,21-16)12-7-5-4-6-8-12/h4-11H,3H2,1-2H3,(H,19,20)
InChIKey IBYCYJFUEJQSMK-UHFFFAOYSA-N
Mol Weight 300.79 g/mol
Molecular Formula C17H17ClN2O
Exact Mass 300.102941 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 2u7Op9JUju8
Name Etifoxine
Source of Sample Cayman Chemical Company
Catalog Number 15999
Lot Number 0458235-8
CAS Registry Number 21715-46-8
Cell Type Capillary tube
Compound Type Pure
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Formula C17H17ClN2O
IUPAC Name 6-Chloro-N-ethyl-4-methyl-4-phenyl-4H-3, 1-benzoxazin-2-amine
InChI InChI=1S/C17H17ClN2O/c1-3-19-16-20-15-10-9-13(18)11-14(15)17(2,21-16)12-7-5-4-6-8-12/h4-11H,3H2,1-2H3,(H,19,20)
InChIKey IBYCYJFUEJQSMK-UHFFFAOYSA-N
Raman Corrections Referenced to internal white light source; 180 degree backscatter
Raman Laser Power 1401 mW
Raman Laser Source Nd:YAG
SMILES N(\C1=N\c2c(cc(cc2)Cl)C(O1)(c1ccccc1)C)CC
Scans Performed 3008
Source of Spectrum Forensic Spectral Research
Synonyms Etafenoxine; HOE 36-801; Stresam
Technique FT-Raman