CID 204164

Diethyl 1-piperidin-1-ylpropan-2-yl phosphate

Structural Information

Molecular Formula
C12H26NO4P
SMILES
CCOP(=O)(OCC)OC(C)CN1CCCCC1
InChI
InChI=1S/C12H26NO4P/c1-4-15-18(14,16-5-2)17-12(3)11-13-9-7-6-8-10-13/h12H,4-11H2,1-3H3
InChIKey
QOUGNHXZJRWYJO-UHFFFAOYSA-N
Compound name
diethyl 1-piperidin-1-ylpropan-2-yl phosphate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

279.15994 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.16722 168.9
[M+Na]+ 302.14916 171.4
[M-H]- 278.15266 168.2
[M+NH4]+ 297.19376 183.6
[M+K]+ 318.12310 171.7
[M+H-H2O]+ 262.15720 159.3
[M+HCOO]- 324.15814 190.4
[M+CH3COO]- 338.17379 199.6
[M+Na-2H]- 300.13461 168.6
[M]+ 279.15939 171.5
[M]- 279.16049 171.5
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

No patent data available for this compound.