CID 11697

Amidopyrophosphoric acid, diethyl-, trimethyl ester

Structural Information

Molecular Formula
C7H19NO6P2
SMILES
CCN(CC)P(=O)(OC)OP(=O)(OC)OC
InChI
InChI=1S/C7H19NO6P2/c1-6-8(7-2)15(9,11-3)14-16(10,12-4)13-5/h6-7H2,1-5H3
InChIKey
KWNADQGGXNRKNB-UHFFFAOYSA-N
Compound name
[diethylamino(methoxy)phosphoryl] dimethyl phosphate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.06876 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.07604 161.0
[M+Na]+ 298.05798 167.1
[M-H]- 274.06148 160.5
[M+NH4]+ 293.10258 179.4
[M+K]+ 314.03192 170.2
[M+H-H2O]+ 258.06602 151.3
[M+HCOO]- 320.06696 193.1
[M+CH3COO]- 334.08261 204.0
[M+Na-2H]- 296.04343 164.0
[M]+ 275.06821 172.5
[M]- 275.06931 172.5
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.