CID 218604

2-hydroxy-5-iodo-3-methylbenzamide

Structural Information

Molecular Formula
C8H8INO2
SMILES
CC1=CC(=CC(=C1O)C(=O)N)I
InChI
InChI=1S/C8H8INO2/c1-4-2-5(9)3-6(7(4)11)8(10)12/h2-3,11H,1H3,(H2,10,12)
InChIKey
ZSBRSRPSPOMQHJ-UHFFFAOYSA-N
Compound name
2-hydroxy-5-iodo-3-methylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

276.96 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.96728 147.4
[M+Na]+ 299.94922 149.2
[M-H]- 275.95272 143.2
[M+NH4]+ 294.99382 162.1
[M+K]+ 315.92316 152.7
[M+H-H2O]+ 259.95726 138.4
[M+HCOO]- 321.95820 165.2
[M+CH3COO]- 335.97385 188.9
[M+Na-2H]- 297.93467 138.5
[M]+ 276.95945 143.4
[M]- 276.96055 143.4
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