CID 114074

63704-62-1

Structural Information

Molecular Formula
C10H28N4O3P2
SMILES
CCN(C)P(=O)(N(C)C)OP(=O)(N(C)C)N(C)CC
InChI
InChI=1S/C10H28N4O3P2/c1-9-13(7)18(15,11(3)4)17-19(16,12(5)6)14(8)10-2/h9-10H2,1-8H3
InChIKey
XPDINFYMQPIJDG-UHFFFAOYSA-N
Compound name
N-[dimethylamino-[dimethylamino-[ethyl(methyl)amino]phosphoryl]oxyphosphoryl]-N-methylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

314.16367 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.17095 175.6
[M+Na]+ 337.15289 214.1
[M-H]- 313.15639 206.8
[M+NH4]+ 332.19749 211.1
[M+K]+ 353.12683 184.0
[M+H-H2O]+ 297.16093 164.3
[M+HCOO]- 359.16187 209.5
[M+CH3COO]- 373.17752 231.8
[M+Na-2H]- 335.13834 175.2
[M]+ 314.16312 193.0
[M]- 314.16422 193.0
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.