CID 446909

Piperidin-1-ylmethanol

Structural Information

Molecular Formula
C6H13NO
SMILES
C1CCN(CC1)CO
InChI
InChI=1S/C6H13NO/c8-6-7-4-2-1-3-5-7/h8H,1-6H2
InChIKey
RJUAEBLXGFKZMS-UHFFFAOYSA-N
Compound name
piperidin-1-ylmethanol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

2800
Patents

115.09972 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.106996 124.5
[M+Na]+ 138.088938 129.6
[M-H]- 114.092444 124.6
[M+NH4]+ 133.133543 144.9
[M+K]+ 154.062878 128.8
[M+H-H2O]+ 98.096980 118.7
[M+HCOO]- 160.097921 143.1
[M+CH3COO]- 174.113571 165.3
[M+Na-2H]- 136.074386 130.8
[M]+ 115.09917142 119.1
[M]- 115.10026858 119.1
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

patents stripe