CID 2733351

685-83-6

Structural Information

Molecular Formula
C8H20ClN2P
SMILES
CCN(CC)P(N(CC)CC)Cl
InChI
InChI=1S/C8H20ClN2P/c1-5-10(6-2)12(9)11(7-3)8-4/h5-8H2,1-4H3
InChIKey
JVEHJSIFWIIFHM-UHFFFAOYSA-N
Compound name
N-[chloro(diethylamino)phosphanyl]-N-ethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

232
Patents

210.10527 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.11255 153.2
[M+Na]+ 233.09449 158.5
[M-H]- 209.09799 154.8
[M+NH4]+ 228.13909 174.4
[M+K]+ 249.06843 158.3
[M+H-H2O]+ 193.10253 145.9
[M+HCOO]- 255.10347 179.0
[M+CH3COO]- 269.11912 201.7
[M+Na-2H]- 231.07994 152.4
[M]+ 210.10472 159.2
[M]- 210.10582 159.2
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.