CID 182960

Pinidinol

Structural Information

Molecular Formula
C9H19NO
SMILES
C[C@@H]1CCC[C@@H](N1)C[C@@H](C)O
InChI
InChI=1S/C9H19NO/c1-7-4-3-5-9(10-7)6-8(2)11/h7-11H,3-6H2,1-2H3/t7-,8-,9-/m1/s1
InChIKey
DVJHWTLBEYCZJZ-IWSPIJDZSA-N
Compound name
(2R)-1-[(2R,6R)-6-methylpiperidin-2-yl]propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

157.14667 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.153946 138.9
[M+Na]+ 180.135888 143.0
[M-H]- 156.139394 137.5
[M+NH4]+ 175.180493 157.1
[M+K]+ 196.109828 140.9
[M+H-H2O]+ 140.143930 133.1
[M+HCOO]- 202.144871 154.0
[M+CH3COO]- 216.160521 173.8
[M+Na-2H]- 178.121336 141.1
[M]+ 157.14612142 132.4
[M]- 157.14721858 132.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.