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]+ 174.14887 141.0
[M+Na]+ 196.13081 144.7
[M-H]- 172.13431 140.4
[M+NH4]+ 191.17541 158.9
[M+K]+ 212.10475 143.5
[M+H-H2O]+ 156.13885 134.2
[M+HCOO]- 218.13979 158.8
[M+CH3COO]- 232.15544 176.4
[M+Na-2H]- 194.11626 145.6
[M]+ 173.14104 138.1
[M]- 173.14214 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