CID 98016

3-hydroxy-1-methylpiperidine

Structural Information

Molecular Formula
C6H13NO
SMILES
CN1CCCC(C1)O
InChI
InChI=1S/C6H13NO/c1-7-4-2-3-6(8)5-7/h6,8H,2-5H2,1H3
InChIKey
UKANCZCEGQDKGF-UHFFFAOYSA-N
Compound name
1-methylpiperidin-3-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

2
References

2001
Patents

115.09972 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.10700 123.8
[M+Na]+ 138.08894 134.8
[M+NH4]+ 133.13354 132.7
[M+K]+ 154.06288 129.2
[M-H]- 114.09244 125.0
[M+Na-2H]- 136.07439 128.9
[M]+ 115.09917 125.5
[M]- 115.10027 125.5
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