CID 63726972

N-[(oxan-4-yl)methyl]piperidin-4-amine dihydrochloride

Structural Information

Molecular Formula
C11H22N2O
SMILES
C1CNCCC1NCC2CCOCC2
InChI
InChI=1S/C11H22N2O/c1-5-12-6-2-11(1)13-9-10-3-7-14-8-4-10/h10-13H,1-9H2
InChIKey
QSFOSKIPUTVUHC-UHFFFAOYSA-N
Compound name
N-(oxan-4-ylmethyl)piperidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

198.17322 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.18050 147.8
[M+Na]+ 221.16244 148.2
[M-H]- 197.16594 150.0
[M+NH4]+ 216.20704 162.3
[M+K]+ 237.13638 146.6
[M+H-H2O]+ 181.17048 139.6
[M+HCOO]- 243.17142 161.9
[M+CH3COO]- 257.18707 182.1
[M+Na-2H]- 219.14789 152.1
[M]+ 198.17267 137.2
[M]- 198.17377 137.2
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.