2,3-Dehydrodeoxamuscarone
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Basic information
- CAS
79195-22-5- Standard SMILES
CC1=CC(C[N+](C)(C)C)CC1=O.[I-]- InChIKey
JNKUQDCQISILOT-UHFFFAOYSA-M- Molecular formula
- C10H18INO
- Average molar mass
- 295.16 g/mol
- Monoisotopic mass
- 295.04331
Overview
structure given in first source
Names & identifiers
- Preferred name
- 2,3-Dehydrodeoxamuscarone
- IUPAC
- trimethyl-[(3-methyl-4-oxocyclopent-2-en-1-yl)methyl]azanium iodide
- English name
- 2,3-dehydrodeoxamuscarone
- Molecular formula
- C10H18INO
- Molecular weight
- 295.16
Names & synonyms
79195-22-52-Cyclopentene-1-methanaminium, N,N,N,3-tetramethyl-4-oxo-, iodide2,3-Dehydrodeoxamuscarone3-Methyl-4-oxo-1-(N,N-dimethylaminomethyl)cyclopent-2-eneRefChem:81519DTXSID101000331trimethyl-[(3-methyl-4-oxocyclopent-2-en-1-yl)methyl]azanium;iodideN,N,N-Trimethyl(3-methyl-4-oxocyclopent-2-en-1-yl)methanaminium iodide
Database identifiers
- CAS
79195-22-5- PubChem CID
- 133175
- DTXSID
DTXSID101000331
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 222
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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