Chem
J-GLOBAL ID:200907028975029753   Nikkaji number:J816.307C

2,2,5-Trinitroadamantan-7-ol

2,2,5-トリニトロアダマンタン-7-オール
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: C10H13[N+]3O4[O-]3
Molecular formula furigana: C10-H13-N3-O7
Molecular weight: 287.228
InChI: InChI=1S/C10H13N3O7/c14-9-3-6-1-8(5-9,11(15)16)2-7(4-9)10(6,12(17)18)13(19)20/h6-7,14H,1-5H2/t6-,7+,8+,9-
InChI key: IMEQLTCHUUNANE-OJOKCITNSA-N
SMILES: O[C@]12C[C@H]3C[C@](C[C@@H](C1)C3([N+](=O)[O-])[N+](=O)[O-])(C2)[N+](=O)[O-]
Systematic name  (3):
  • 2,2,5-トリニトロアダマンタン-7-オール
  • (1s,3r,5R,7S)-3,6,6-トリニトロアダマンタン-1-オール
  • (1s,3r,5R,7S)-3,6,6-trinitroadamantan-1-ol
Other name (1):
  • 2,2,5-Trinitroadamantan-7-ol
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