Chem
J-GLOBAL ID:200907050074157812   Nikkaji number:J1.894.914H

(S)-3-[(R)-α-Hydroxy-4-nitrobenzyl]-2-butanone

(S)-3-[(R)-α-ヒドロキシ-4-ニトロベンジル]-2-ブタノン
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: C11H13[N+]O3[O-]
Molecular formula furigana: C11-H13-N-O4
Molecular weight: 223.228
InChI: InChI=1S/C11H13NO4/c1-7(8(2)13)11(14)9-3-5-10(6-4-9)12(15)16/h3-7,11,14H,1-2H3/t7-,11-/m1/s1
InChI key: SHQWHOLGKWLWAN-RDDDGLTNSA-N
SMILES: C[C@@H]([C@@H](O)c1ccc(cc1)[N+](=O)[O-])C(=O)C
Systematic name  (6):
  • (3S,4R)-3-メチル-4-ヒドロキシ-4-(4-ニトロフェニル)-2-ブタノン
  • (S)-3-[(R)-α-ヒドロキシ-4-ニトロベンジル]-2-ブタノン
  • (3S,4R)-3-メチル-4-ヒドロキシ-4-(4-ニトロフェニル)ブタン-2-オン
  • (3S,4R)-4-ヒドロキシ-3-メチル-4-(4-ニトロフェニル)-2-ブタノン
  • (3S,4R)-4-ヒドロキシ-3-メチル-4-(4-ニトロフェニル)ブタン-2-オン
Show all
Other name (4):
  • (3S,4R)-3-Methyl-4-hydroxy-4-(4-nitrophenyl)-2-butanone
  • (S)-3-[(R)-α-Hydroxy-4-nitrobenzyl]-2-butanone
  • (3S,4R)-3-Methyl-4-hydroxy-4-(4-nitrophenyl)butane-2-one
  • (3S,4R)-4-Hydroxy-3-methyl-4-(4-nitrophenyl)-2-butanone
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