CID 130477447

4-cyclobutylpiperidine-4-carbonitrile

Structural Information

Molecular Formula
C10H16N2
SMILES
C1CC(C1)C2(CCNCC2)C#N
InChI
InChI=1S/C10H16N2/c11-8-10(9-2-1-3-9)4-6-12-7-5-10/h9,12H,1-7H2
InChIKey
DVDHGIXTISMRQA-UHFFFAOYSA-N
Compound name
4-cyclobutylpiperidine-4-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

164.13135 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.138626 131.7
[M+Na]+ 187.120568 137.4
[M-H]- 163.124074 134.3
[M+NH4]+ 182.165173 144.1
[M+K]+ 203.094508 137.1
[M+H-H2O]+ 147.128610 115.2
[M+HCOO]- 209.129551 144.8
[M+CH3COO]- 223.145201 190.4
[M+Na-2H]- 185.106016 137.0
[M]+ 164.13080142 127.9
[M]- 164.13189858 127.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.