CID 209566

19999-63-4

Structural Information

Molecular Formula
C8H18NO
SMILES
C[N+]1(CCCCC1)CCO
InChI
InChI=1S/C8H18NO/c1-9(7-8-10)5-3-2-4-6-9/h10H,2-8H2,1H3/q+1
InChIKey
OREKCTYCBSSFON-UHFFFAOYSA-N
Compound name
2-(1-methylpiperidin-1-ium-1-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

133
Patents

144.13884 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.14612 131.6
[M+Na]+ 167.12806 136.7
[M-H]- 143.13156 132.0
[M+NH4]+ 162.17266 152.8
[M+K]+ 183.10200 130.0
[M+H-H2O]+ 127.13610 129.1
[M+HCOO]- 189.13704 149.2
[M+CH3COO]- 203.15269 164.4
[M+Na-2H]- 165.11351 140.2
[M]+ 144.13829 125.5
[M]- 144.13939 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

No literature data available for this compound.

Patent stripe

patents stripe