None

AlkaPlorer ID: AK318646

Synonym: None

IUPAC Name: 1-isocyano-1-methyl-4-(6-methylhepta-2,4-dien-2-yl)cyclohexane

Structure

SMILES: [C-]#[N+][C@]1(C)CC[C@H](C(C)=CC=CC(C)C)CC1

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InChI: InChI=1S/C16H25N/c1-13(2)7-6-8-14(3)15-9-11-16(4,17-5)12-10-15/h6-8,13,15H,9-12H2,1-4H3/t15-,16+

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InChIKey: MARLZIFXCZUGPF-IYBDPMFKSA-N

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Reference

NPASS: NPC149229

Properties Information

Molecule Weight: 231.383

TPSA: 4.36

MolLogP: 5.013090000000005

Number of H-Donors: 0

Number of H-Acceptors: 0

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information