CID 6481044

2-hydroxy-5-iodo-n-(5-methylisoxazol-3-yl)benzamide

Structural Information

Molecular Formula
C11H9IN2O3
SMILES
CC1=CC(=NO1)NC(=O)C2=C(C=CC(=C2)I)O
InChI
InChI=1S/C11H9IN2O3/c1-6-4-10(14-17-6)13-11(16)8-5-7(12)2-3-9(8)15/h2-5,15H,1H3,(H,13,14,16)
InChIKey
IYAUNALAISTKCY-UHFFFAOYSA-N
Compound name
2-hydroxy-5-iodo-N-(5-methyl-1,2-oxazol-3-yl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

343.9658 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 344.97308 163.0
[M+Na]+ 366.95502 164.7
[M-H]- 342.95852 161.5
[M+NH4]+ 361.99962 174.2
[M+K]+ 382.92896 168.6
[M+H-H2O]+ 326.96306 152.2
[M+HCOO]- 388.96400 180.7
[M+CH3COO]- 402.97965 197.9
[M+Na-2H]- 364.94047 154.8
[M]+ 343.96525 161.6
[M]- 343.96635 161.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.