Chem
J-GLOBAL ID:200907027559151225   Nikkaji number:J717.224I

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

(S)-2-[(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-/m1/s1
InChI key: LWDGESCTOIIBJJ-DGCLKSJQSA-N
SMILES: O[C@@H]([C@@H]1CCCCC1=O)c1ccc(cc1)[N+](=O)[O-]
Systematic name  (13):
  • (S)-2-[(S)-α-ヒドロキシ-4-ニトロベンジル]シクロヘキサノン
  • (2S)-2-[(S)-α-ヒドロキシ-4-ニトロベンジル]シクロヘキサノン
  • (2S)-2α-[(S)-α-ヒドロキシ-4-ニトロベンジル]シクロヘキサノン
  • (S)-2-[(S)-α-ヒドロキシ-4-ニトロベンジル]シクロヘキサン-1-オン
  • (S)-2α-[(S)-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 (11):
  • (S)-2-[(S)-α-Hydroxy-4-nitrobenzyl]cyclohexanone
  • (2S)-2-[(S)-α-Hydroxy-4-nitrobenzyl]cyclohexanone
  • (2S)-2α-[(S)-α-Hydroxy-4-nitrobenzyl]cyclohexanone
  • (S)-2-[(S)-α-Hydroxy-4-nitrobenzyl]cyclohexane-1-one
  • (S)-2α-[(S)-α-Hydroxy-4-nitrobenzyl]cyclohexanone
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