CID 118279418

4-(2-hydroxypropan-2-yl)piperidin-4-olhydrochloride

Structural Information

Molecular Formula
C8H17NO2
SMILES
CC(C)(C1(CCNCC1)O)O
InChI
InChI=1S/C8H17NO2/c1-7(2,10)8(11)3-5-9-6-4-8/h9-11H,3-6H2,1-2H3
InChIKey
ICSKAVDIUYLMNS-UHFFFAOYSA-N
Compound name
4-(2-hydroxypropan-2-yl)piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

159.12593 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.13321 136.3
[M+Na]+ 182.11515 144.6
[M+NH4]+ 177.15975 144.6
[M+K]+ 198.08909 139.2
[M-H]- 158.11865 135.0
[M+Na-2H]- 180.10060 140.9
[M]+ 159.12538 136.9
[M]- 159.12648 136.9
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

patents stripe