CID 114358

63867-49-2

Structural Information

Molecular Formula
C7H15ClFN2O2P
SMILES
C1CNP(=O)(OC1)N(CCF)CCCl
InChI
InChI=1S/C7H15ClFN2O2P/c8-2-5-11(6-3-9)14(12)10-4-1-7-13-14/h1-7H2,(H,10,12)
InChIKey
CKKPZBXIMKKKBT-UHFFFAOYSA-N
Compound name
N-(2-chloroethyl)-N-(2-fluoroethyl)-2-oxo-1,3,2lambda5-oxazaphosphinan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.05437 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.06165 150.5
[M+Na]+ 267.04359 155.9
[M-H]- 243.04709 149.9
[M+NH4]+ 262.08819 167.9
[M+K]+ 283.01753 154.5
[M+H-H2O]+ 227.05163 141.8
[M+HCOO]- 289.05257 169.3
[M+CH3COO]- 303.06822 190.9
[M+Na-2H]- 265.02904 153.1
[M]+ 244.05382 149.7
[M]- 244.05492 149.7
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.