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1-(5'-Bromopent-4'-ynyl)-6-hydroxypiperidin-2-one
SpectraBase Compound ID KAHzCN2FSCT
InChI InChI=1S/C10H14BrNO2/c11-7-2-1-3-8-12-9(13)5-4-6-10(12)14/h9,13H,1,3-6,8H2
InChIKey IXYUTLCCDNXNFJ-UHFFFAOYSA-N
Mol Weight 260.13 g/mol
Molecular Formula C10H14BrNO2
Exact Mass 259.020792 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1FqBodj58vH
Name 1-(5'-Bromopent-4'-ynyl)-6-hydroxypiperidin-2-one
Comments Note: The molecular formula of the structure shown is C10H14BrNO2 - which differs from the formula reported for the mass spectrum (C10H18BrNO2)
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Formula C10H18BrNO2
InChI InChI=1S/C10H14BrNO2/c11-7-2-1-3-8-12-9(13)5-4-6-10(12)14/h9,13H,1,3-6,8H2
InChIKey IXYUTLCCDNXNFJ-UHFFFAOYSA-N
Molecular Weight 260.131 g/mol
SMILES OC1CCCC(N1CCCC#CBr)=O
SPLASH splash10-08gi-8910000000-1e9f2b993af9fdd0332e
Source of Spectrum AC-1994-100-11
Wiley ID 811750