CID 3046654

62484-89-3

Structural Information

Molecular Formula
C10H21ClNO3P
SMILES
CCCOP(=O)(N(CC)CC)OCC(=C)Cl
InChI
InChI=1S/C10H21ClNO3P/c1-5-8-14-16(13,12(6-2)7-3)15-9-10(4)11/h4-9H2,1-3H3
InChIKey
IKNBEHDALFQGMA-UHFFFAOYSA-N
Compound name
N-[2-chloroprop-2-enoxy(propoxy)phosphoryl]-N-ethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.09476 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.10204 162.6
[M+Na]+ 292.08398 168.8
[M-H]- 268.08748 163.0
[M+NH4]+ 287.12858 181.2
[M+K]+ 308.05792 167.4
[M+H-H2O]+ 252.09202 155.9
[M+HCOO]- 314.09296 186.1
[M+CH3COO]- 328.10861 203.5
[M+Na-2H]- 290.06943 163.1
[M]+ 269.09421 171.5
[M]- 269.09531 171.5
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.