CID 3046657

62484-93-9

Structural Information

Molecular Formula
C11H21ClNO3P
SMILES
CCCCOP(=O)(N1CCCC1)OCC(=C)Cl
InChI
InChI=1S/C11H21ClNO3P/c1-3-4-9-15-17(14,16-10-11(2)12)13-7-5-6-8-13/h2-10H2,1H3
InChIKey
DBSZKQHLPQSTJL-UHFFFAOYSA-N
Compound name
1-[butoxy(2-chloroprop-2-enoxy)phosphoryl]pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.09476 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.10204 166.1
[M+Na]+ 304.08398 171.2
[M-H]- 280.08748 166.0
[M+NH4]+ 299.12858 183.5
[M+K]+ 320.05792 168.5
[M+H-H2O]+ 264.09202 157.9
[M+HCOO]- 326.09296 185.4
[M+CH3COO]- 340.10861 196.9
[M+Na-2H]- 302.06943 164.7
[M]+ 281.09421 170.1
[M]- 281.09531 170.1
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.