CID 231349

16834-57-4

Structural Information

Molecular Formula
C15H26NO5P
SMILES
CCOP(=O)(CC1=CC=C(C=C1)N(CCO)CCO)OCC
InChI
InChI=1S/C15H26NO5P/c1-3-20-22(19,21-4-2)13-14-5-7-15(8-6-14)16(9-11-17)10-12-18/h5-8,17-18H,3-4,9-13H2,1-2H3
InChIKey
QRJPJVKJJQOLOK-UHFFFAOYSA-N
Compound name
2-[4-(diethoxyphosphorylmethyl)-N-(2-hydroxyethyl)anilino]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

331.15485 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 332.16213 178.9
[M+Na]+ 354.14407 186.2
[M+NH4]+ 349.18867 183.1
[M+K]+ 370.11801 182.4
[M-H]- 330.14757 177.6
[M+Na-2H]- 352.12952 181.0
[M]+ 331.15430 179.1
[M]- 331.15540 179.1
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