CID 11481364

N,n-dipropyl phosphoramidic dichloride

Structural Information

Molecular Formula

C₆H₁₄Cl₂NOP

SMILES

CCCN(CCC)P(=O)(Cl)Cl

InChI

InChI=1S/C6H14Cl2NOP/c1-3-5-9(6-4-2)11(7,8)10/h3-6H2,1-2H3

InChIKey

QGTICFYFHGGDJW-UHFFFAOYSA-N

Compound name

N-dichlorophosphoryl-N-propylpropan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 217.01901 Da
Monoisotopic Mass: 3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	218.026286	145.5
[M+Na]+	240.008228	153.8
[M-H]-	216.011734	145.9
[M+NH4]+	235.052833	166.7
[M+K]+	255.982168	150.7
[M+H-H2O]+	200.016270	140.5
[M+HCOO]-	262.017211	165.3
[M+CH3COO]-	276.032861	192.4
[M+Na-2H]-	237.993676	148.2
[M]+	217.01846142	152.0
[M]-	217.01955858	152.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe