CID 17750184

2-ethoxy-3-iodopyridine

Structural Information

Molecular Formula
C7H8INO
SMILES
CCOC1=C(C=CC=N1)I
InChI
InChI=1S/C7H8INO/c1-2-10-7-6(8)4-3-5-9-7/h3-5H,2H2,1H3
InChIKey
QOCXFQFGXYWCHJ-UHFFFAOYSA-N
Compound name
2-ethoxy-3-iodopyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

64
Patents

248.96506 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.97234 134.5
[M+Na]+ 271.95428 136.3
[M-H]- 247.95778 130.0
[M+NH4]+ 266.99888 150.0
[M+K]+ 287.92822 140.9
[M+H-H2O]+ 231.96232 124.7
[M+HCOO]- 293.96326 153.3
[M+CH3COO]- 307.97891 182.9
[M+Na-2H]- 269.93973 130.6
[M]+ 248.96451 133.5
[M]- 248.96561 133.5
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

patents stripe