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
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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:
C11 H13 [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
(3S,4R)-4-hydroxy-3-methyl-4-(4-nitrophenyl)butan-2-one
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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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