CID 84765312

1-cyclobutylpiperidine-4-carbaldehyde

Structural Information

Molecular Formula
C10H17NO
SMILES
C1CC(C1)N2CCC(CC2)C=O
InChI
InChI=1S/C10H17NO/c12-8-9-4-6-11(7-5-9)10-2-1-3-10/h8-10H,1-7H2
InChIKey
NNEINOCBKRWDSJ-UHFFFAOYSA-N
Compound name
1-cyclobutylpiperidine-4-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

167.13101 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.138286 133.3
[M+Na]+ 190.120228 136.9
[M-H]- 166.123734 137.4
[M+NH4]+ 185.164833 145.8
[M+K]+ 206.094168 138.5
[M+H-H2O]+ 150.128270 121.5
[M+HCOO]- 212.129211 150.8
[M+CH3COO]- 226.144861 182.0
[M+Na-2H]- 188.105676 137.3
[M]+ 167.13046142 136.8
[M]- 167.13155858 136.8
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