CID 3046660

62484-96-2

Structural Information

Molecular Formula
C13H25ClNO3P
SMILES
CCCCCCOP(=O)(N1CCCC1)OCC(=C)Cl
InChI
InChI=1S/C13H25ClNO3P/c1-3-4-5-8-11-17-19(16,18-12-13(2)14)15-9-6-7-10-15/h2-12H2,1H3
InChIKey
FQYWTLOIIUNPAJ-UHFFFAOYSA-N
Compound name
1-[2-chloroprop-2-enoxy(hexoxy)phosphoryl]pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

309.12607 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.13335 171.5
[M+Na]+ 332.11529 178.4
[M+NH4]+ 327.15989 176.8
[M+K]+ 348.08923 175.1
[M-H]- 308.11879 169.2
[M+Na-2H]- 330.10074 172.3
[M]+ 309.12552 171.6
[M]- 309.12662 171.6
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.