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]+ 199.180496 147.8
[M+Na]+ 221.162438 148.2
[M-H]- 197.165944 150.0
[M+NH4]+ 216.207043 162.3
[M+K]+ 237.136378 146.6
[M+H-H2O]+ 181.170480 139.6
[M+HCOO]- 243.171421 161.9
[M+CH3COO]- 257.187071 182.1
[M+Na-2H]- 219.147886 152.1
[M]+ 198.17267142 137.2
[M]- 198.17376858 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

patents stripe