CID 61242820

{4-[(propan-2-yl)amino]piperidin-4-yl}methanol dihydrochloride

Structural Information

Molecular Formula
C9H20N2O
SMILES
CC(C)NC1(CCNCC1)CO
InChI
InChI=1S/C9H20N2O/c1-8(2)11-9(7-12)3-5-10-6-4-9/h8,10-12H,3-7H2,1-2H3
InChIKey
UIXASGLQDYPRTR-UHFFFAOYSA-N
Compound name
[4-(propan-2-ylamino)piperidin-4-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

172.15756 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.16484 142.3
[M+Na]+ 195.14678 145.5
[M-H]- 171.15028 140.7
[M+NH4]+ 190.19138 161.2
[M+K]+ 211.12072 143.6
[M+H-H2O]+ 155.15482 136.6
[M+HCOO]- 217.15576 158.4
[M+CH3COO]- 231.17141 177.2
[M+Na-2H]- 193.13223 146.6
[M]+ 172.15701 134.9
[M]- 172.15811 134.9
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.