CID 3657540

2-cyclobutylpiperidine

Structural Information

Molecular Formula
C9H17N
SMILES
C1CCNC(C1)C2CCC2
InChI
InChI=1S/C9H17N/c1-2-7-10-9(6-1)8-4-3-5-8/h8-10H,1-7H2
InChIKey
TTWXQGZANCNAFO-UHFFFAOYSA-N
Compound name
2-cyclobutylpiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

139.1361 Da
Monoisotopic Mass

2.0
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

No literature data available for this compound.

Patent stripe

patents stripe