Chem
J-GLOBAL ID：200907025584814970   Nikkaji number：J1.894.950D

2β-[(S)-α-Hydroxy-4-nitrobenzyl]cyclohexanone

2β-[(S)-α-ヒドロキシ-4-ニトロベンジル]シクロヘキサノン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C13H15[N+]O3[O-]
Molecular formula furigana： C13-H15-N-O4
Molecular weight： 249.266
InChI： InChI=1S/C13H15NO4/c15-12-4-2-1-3-11(12)13(16)9-5-7-10(8-6-9)14(17)18/h5-8,11,13,16H,1-4H2/t11-,13+/m0/s1
InChI key： LWDGESCTOIIBJJ-WCQYABFASA-N
SMILES： O[C@@H]([C@H]1CCCCC1=O)c1ccc(cc1)[N+](=O)[O-]
Systematic name  (16)：
  • (2R)-2-[(S)-α-ヒドロキシ-4-ニトロベンジル]シクロヘキサノン
  • 2β-[(S)-α-ヒドロキシ-4-ニトロベンジル]シクロヘキサノン
  • (2R)-2β-[(S)-α-ヒドロキシ-4-ニトロベンジル]シクロヘキサノン
  • (R)-2-[(S)-4-ニトロ-α-ヒドロキシベンジル]シクロヘキサノン
  • (2R)-2-[(αS)-α-ヒドロキシ-4-ニトロベンジル]シクロヘキサノン
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Other name (14)：
  • (2R)-2-[(S)-α-Hydroxy-4-nitrobenzyl]cyclohexanone
  • 2β-[(S)-α-Hydroxy-4-nitrobenzyl]cyclohexanone
  • (2R)-2β-[(S)-α-Hydroxy-4-nitrobenzyl]cyclohexanone
  • (R)-2-[(S)-4-Nitro-α-hydroxybenzyl]cyclohexanone
  • (2R)-2-[(αS)-α-Hydroxy-4-nitrobenzyl]cyclohexanone
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Thsaurus map：
Thesaurus Map

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