CID 20506404

4-(3-methoxypropoxy)piperidine

Structural Information

Molecular Formula
C9H19NO2
SMILES
COCCCOC1CCNCC1
InChI
InChI=1S/C9H19NO2/c1-11-7-2-8-12-9-3-5-10-6-4-9/h9-10H,2-8H2,1H3
InChIKey
ITYSLFBEYUSSLQ-UHFFFAOYSA-N
Compound name
4-(3-methoxypropoxy)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

173.14159 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.148866 141.0
[M+Na]+ 196.130808 144.7
[M-H]- 172.134314 140.4
[M+NH4]+ 191.175413 158.9
[M+K]+ 212.104748 143.5
[M+H-H2O]+ 156.138850 134.2
[M+HCOO]- 218.139791 158.8
[M+CH3COO]- 232.155441 176.4
[M+Na-2H]- 194.116256 145.6
[M]+ 173.14104142 138.1
[M]- 173.14213858 138.1
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