CID 86726674

4-iodo-2h,3h-furo[2,3-b]pyridine

Structural Information

Molecular Formula
C7H6INO
SMILES
C1COC2=NC=CC(=C21)I
InChI
InChI=1S/C7H6INO/c8-6-1-3-9-7-5(6)2-4-10-7/h1,3H,2,4H2
InChIKey
FSAADSSBMPFVLA-UHFFFAOYSA-N
Compound name
4-iodo-2,3-dihydrofuro[2,3-b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

73
Patents

246.94942 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.956696 128.5
[M+Na]+ 269.938638 130.8
[M-H]- 245.942144 125.4
[M+NH4]+ 264.983243 145.4
[M+K]+ 285.912578 135.8
[M+H-H2O]+ 229.946680 119.3
[M+HCOO]- 291.947621 145.8
[M+CH3COO]- 305.963271 139.0
[M+Na-2H]- 267.924086 125.3
[M]+ 246.94887142 126.3
[M]- 246.94996858 126.3
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

patents stripe