Chem
J-GLOBAL ID:201207011810813374
Nikkaji number:J3.057.881C
(5R)-5α-[(R)-2-Nitro-1-phenylethyl]-5-methylfuran-2(5H)-one
(5R)-5α-[(R)-2-ニトロ-1-フェニルエチル]-5-メチルフラン-2(5H)-オン
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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:
C13 H13 [N+]O3 [O-]
Molecular formula furigana:
C13-H13-N-O4
Molecular weight:
247.250
InChI:
InChI=1S/C13H13NO4/c1-13(8-7-12(15)18-13)11(9-14(16)17)10-5-3-2-4-6-10/h2-8,11H,9H2,1H3/t11-,13+/m0/s1
InChI key:
UYDABEHZUOLWJV-WCQYABFASA-N
SMILES:
C[C@]1(OC(=O)C=C1)[C@@H](C[N+](=O)[O-])c1ccccc1
Systematic name (4):
(5R)-5α-[(R)-2-ニトロ-1-フェニルエチル]-5-メチルフラン-2(5H)-オン
(R)-5β-メチル-5-[(R)-α-(ニトロメチル)ベンジル]-2,5-ジヒドロフラン-2-オン
(5R)-5-メチル-5-[(1R)-2-ニトロ-1-フェニルエチル]-2,5-ジヒドロフラン-2-オン
(5R)-5-methyl-5-[(1R)-2-nitro-1-phenylethyl]-2,5-dihydrofuran-2-one
Other name (2):
(5R)-5α-[(R)-2-Nitro-1-phenylethyl]-5-methylfuran-2(5H)-one
(R)-5β-Methyl-5-[(R)-α-(nitromethyl)benzyl]-2,5-dihydrofuran-2-one
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