CID 3076695

Brn 4752706

Structural Information

Molecular Formula
C11H22NO6P
SMILES
CC(=O)NCCCC(=O)OCCCP(=O)(OC)OC
InChI
InChI=1S/C11H22NO6P/c1-10(13)12-7-4-6-11(14)18-8-5-9-19(15,16-2)17-3/h4-9H2,1-3H3,(H,12,13)
InChIKey
RRTUVQHLPYTNHO-UHFFFAOYSA-N
Compound name
3-dimethoxyphosphorylpropyl 4-acetamidobutanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.11847 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.12575 167.9
[M+Na]+ 318.10769 172.6
[M+NH4]+ 313.15229 170.6
[M+K]+ 334.08163 170.9
[M-H]- 294.11119 163.1
[M+Na-2H]- 316.09314 166.5
[M]+ 295.11792 166.4
[M]- 295.11902 166.4
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.