CID 3060706

Brn 2375424

Structural Information

Molecular Formula
C8H17Cl2N2O2P
SMILES
CCC1COP(=O)(N1)N(CCCl)CCCl
InChI
InChI=1S/C8H17Cl2N2O2P/c1-2-8-7-14-15(13,11-8)12(5-3-9)6-4-10/h8H,2-7H2,1H3,(H,11,13)
InChIKey
DREOKUIEHRVKQO-UHFFFAOYSA-N
Compound name
N,N-bis(2-chloroethyl)-4-ethyl-2-oxo-1,3,2lambda5-oxazaphospholidin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

274.04047 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.04775 157.4
[M+Na]+ 297.02969 164.4
[M-H]- 273.03319 158.0
[M+NH4]+ 292.07429 176.1
[M+K]+ 313.00363 161.4
[M+H-H2O]+ 257.03773 150.7
[M+HCOO]- 319.03867 173.7
[M+CH3COO]- 333.05432 196.6
[M+Na-2H]- 295.01514 157.7
[M]+ 274.03992 161.1
[M]- 274.04102 161.1
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.