Chem
J-GLOBAL ID：200907044832504022
Nikkaji number：J1.824.364D
2α-[(S)-α-Hydroxy-4-nitrobenzyl]cyclopentanone
2α-[(S)-α-ヒドロキシ-4-ニトロベンジル]シクロペンタノン
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
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
Molecular formula： C12H13[N+]O3[O-]
Molecular formula furigana： C12-H13-N-O4
Molecular weight： 235.239
InChI：
InChI=1S/C12H13NO4/c14-11-3-1-2-10(11)12(15)8-4-6-9(7-5-8)13(16)17/h4-7,10,12,15H,1-3H2/t10-,12-/m1/s1
InChI key：
CIYBYDAJXJZQNN-ZYHUDNBSSA-N
SMILES：
O[C@@H]([C@@H]1CCCC1=O)c1ccc(cc1)[N+](=O)[O-]
Systematic name (8)：
- (2S)-2-[(S)-α-ヒドロキシ-4-ニトロベンジル]シクロペンタノン
- 2α-[(S)-α-ヒドロキシ-4-ニトロベンジル]シクロペンタノン
- (S)-2α-[(S)-α-ヒドロキシ-4-ニトロベンジル]シクロペンタノン
- (2S)-2α-[(S)-α-ヒドロキシ-4-ニトロベンジル]シクロペンタノン
- (S)-2-[(αS)-α-ヒドロキシ-p-ニトロベンジル]シクロペンタノン
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- (2S)-2-[(S)-α-Hydroxy-4-nitrobenzyl]cyclopentanone
- 2α-[(S)-α-Hydroxy-4-nitrobenzyl]cyclopentanone
- (S)-2α-[(S)-α-Hydroxy-4-nitrobenzyl]cyclopentanone
- (2S)-2α-[(S)-α-Hydroxy-4-nitrobenzyl]cyclopentanone
- (S)-2-[(αS)-α-Hydroxy-p-nitrobenzyl]cyclopentanone
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