CID 44478

21089-40-7

Structural Information

Molecular Formula
C7H14Cl2NO3P
SMILES
C1COP(=O)(OC1)N(CCCl)CCCl
InChI
InChI=1S/C7H14Cl2NO3P/c8-2-4-10(5-3-9)14(11)12-6-1-7-13-14/h1-7H2
InChIKey
ZONOPUXXUUEOEC-UHFFFAOYSA-N
Compound name
N,N-bis(2-chloroethyl)-2-oxo-1,3,2lambda5-dioxaphosphinan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.00885 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.01613 152.8
[M+Na]+ 283.99807 159.1
[M-H]- 260.00157 156.7
[M+NH4]+ 279.04267 170.8
[M+K]+ 299.97201 158.8
[M+H-H2O]+ 244.00611 146.8
[M+HCOO]- 306.00705 169.7
[M+CH3COO]- 320.02270 195.0
[M+Na-2H]- 281.98352 156.9
[M]+ 261.00830 157.7
[M]- 261.00940 157.7
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.