CID 155970973

2639449-31-1

Structural Information

Molecular Formula
C10H18IO3P
SMILES
CCOP(=O)(CC12CC(C1)(C2)I)OCC
InChI
InChI=1S/C10H18IO3P/c1-3-13-15(12,14-4-2)8-9-5-10(11,6-9)7-9/h3-8H2,1-2H3
InChIKey
OPZBOFWOAVUYMV-UHFFFAOYSA-N
Compound name
1-(diethoxyphosphorylmethyl)-3-iodobicyclo[1.1.1]pentane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

344.00385 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.01113 175.7
[M+Na]+ 366.99307 173.8
[M-H]- 342.99657 172.8
[M+NH4]+ 362.03767 177.5
[M+K]+ 382.96701 183.3
[M+H-H2O]+ 327.00111 159.9
[M+HCOO]- 389.00205 187.6
[M+CH3COO]- 403.01770 222.6
[M+Na-2H]- 364.97852 171.0
[M]+ 344.00330 200.6
[M]- 344.00440 200.6
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.