CID 54555009

4-cyclobutylpiperidine

Structural Information

Molecular Formula
C9H17N
SMILES
C1CC(C1)C2CCNCC2
InChI
InChI=1S/C9H17N/c1-2-8(3-1)9-4-6-10-7-5-9/h8-10H,1-7H2
InChIKey
LOOQDRUYWDSXME-UHFFFAOYSA-N
Compound name
4-cyclobutylpiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

139.1361 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.14338 128.2
[M+Na]+ 162.12532 130.8
[M-H]- 138.12882 130.8
[M+NH4]+ 157.16992 141.0
[M+K]+ 178.09926 131.8
[M+H-H2O]+ 122.13336 116.7
[M+HCOO]- 184.13430 144.2
[M+CH3COO]- 198.14995 174.4
[M+Na-2H]- 160.11077 132.9
[M]+ 139.13555 128.5
[M]- 139.13665 128.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe