Chem
J-GLOBAL ID:200907050442192143   Nikkaji number:J1.138.937F

4-(4-Oxo-6-hydroxy-6,9-dimethyl-7-phenyladamantane-2-ylidene)morpholinium

4-(4-オキソ-6-ヒドロキシ-6,9-ジメチル-7-フェニルアダマンタン-2-イリデン)モルホリニウム
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: C22H28[N+]O3
Molecular formula furigana: C22-H28-N-O3
Molecular weight: 354.469
InChI: InChI=1S/C22H28NO3/c1-14-16-12-22(15-6-4-3-5-7-15)13-17(20(24)18(14)21(22,2)25)19(16)23-8-10-26-11-9-23/h3-7,14,16-18,25H,8-13H2,1-2H3/q+1/t14?,16-,17-,18+,21?,22-/m0/s1
InChI key: YDWYSCAHIZQTIQ-VQCBPRAKSA-N
SMILES: CC1[C@@H]2C[C@]3(C[C@H](C(=O)[C@@H]1C3(C)O)C2=[N+]1CCOCC1)c1ccccc1
Systematic name  (3):
  • 4-(4-オキソ-6-ヒドロキシ-6,9-ジメチル-7-フェニルアダマンタン-2-イリデン)モルホリニウム
  • 4-[(1S,3S,5S,7S)-6-ヒドロキシ-4,6-ジメチル-9-オキソ-7-フェニルアダマンタン-2-イリデン]-4λ5-モルホリン-4-イリウム
  • 4-[(1S,3S,5S,7S)-6-hydroxy-4,6-dimethyl-9-oxo-7-phenyladamantan-2-ylidene]-4λ5-morpholin-4-ylium
Other name (1):
  • 4-(4-Oxo-6-hydroxy-6,9-dimethyl-7-phenyladamantane-2-ylidene)morpholinium
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