CID 114257

Methyl n,n-dimethylphosphoramidocyanidate

Structural Information

Molecular Formula
C4H9N2O2P
SMILES
CN(C)P(=O)(C#N)OC
InChI
InChI=1S/C4H9N2O2P/c1-6(2)9(7,4-5)8-3/h1-3H3
InChIKey
SKTKJMBOLDLEDR-UHFFFAOYSA-N
Compound name
[dimethylamino(methoxy)phosphoryl]formonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

148.04016 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.04744 124.5
[M+Na]+ 171.02938 133.6
[M-H]- 147.03288 126.0
[M+NH4]+ 166.07398 144.7
[M+K]+ 187.00332 135.6
[M+H-H2O]+ 131.03742 111.6
[M+HCOO]- 193.03836 150.7
[M+CH3COO]- 207.05401 193.4
[M+Na-2H]- 169.01483 129.6
[M]+ 148.03961 123.6
[M]- 148.04071 123.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe