Mid000006: Cyclohexyl isocyanide
Metabolite Information
Name
Cyclohexyl isocyanide
IUPAC Name
isocyanocyclohexane
Molecular Formula
C7H11N
Molecular Weight
109.17
Exact Mass
109.0891494
SMILES
[C-]#[N+]C1CCCCC1
InChIKey
XYZMOVWWVXBHDP-UHFFFAOYSA-N
InChI
InChI=1S/C7H11N/c1-8-7-5-3-2-4-6-7/h7H,2-6H2
Other Databases Link
kegg_C11520
CID_79129
CID_79129
Structure
2D Structure
3D Conformer
Classification
(data sourced from ClassyFire)
Kingdom:
Organic compounds
Superclass:
Organic nitrogen compounds
Class:
Organonitrogen compounds
Subclass:
Organic isocyanides
Species containing this metabolite
| Arabidopsis thaliana | Morus alba | Punica granatum |
Metabolite Spectrum Accession Label