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5-Bromo-6-(3'-oxocyclohex-1'-yl)methyl]-2-methoxypyridine
SpectraBase Compound ID KO22El0FBL4
InChI InChI=1S/C13H16BrNO2/c1-17-13-6-5-11(14)12(15-13)8-9-3-2-4-10(16)7-9/h5-6,9H,2-4,7-8H2,1H3
InChIKey SSXLDWQNMRKZSU-UHFFFAOYSA-N
Mol Weight 298.18 g/mol
Molecular Formula C13H16BrNO2
Exact Mass 297.036442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3w0GqmKi5y0
Name 5-Bromo-6-(3'-oxocyclohex-1'-yl)methyl]-2-methoxypyridine
Alternate Name(s) 3-[(3-bromo-6-methoxy-2-pyridinyl)methyl]-1-cyclohexanone 3-[(3-bromo-6-methoxypyridin-2-yl)methyl]cyclohexan-1-one 3-[(3-bromanyl-6-methoxy-pyridin-2-yl)methyl]cyclohexan-1-one
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Formula C13H16BrNO2
InChI InChI=1S/C13H16BrNO2/c1-17-13-6-5-11(14)12(15-13)8-9-3-2-4-10(16)7-9/h5-6,9H,2-4,7-8H2,1H3
InChIKey SSXLDWQNMRKZSU-UHFFFAOYSA-N
Molecular Weight 298.180 g/mol
SMILES c1(nc(ccc1Br)OC)CC1CC(=O)CCC1
SPLASH splash10-0udi-1090000000-a35a991f52c5d1dd78b1
Source of Spectrum SK-24-1375-16
Wiley ID 866112