CID 2743080

31419-81-5

Structural Information

Molecular Formula
C8H8Br2N2O2
SMILES
COC1=C(C=C(C=C1Br)C(=NO)N)Br
InChI
InChI=1S/C8H8Br2N2O2/c1-14-7-5(9)2-4(3-6(7)10)8(11)12-13/h2-3,13H,1H3,(H2,11,12)
InChIKey
KDCMGKXESJFOMD-UHFFFAOYSA-N
Compound name
3,5-dibromo-N'-hydroxy-4-methoxybenzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

321.89526 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 322.90254 146.0
[M+Na]+ 344.88448 155.9
[M-H]- 320.88798 152.2
[M+NH4]+ 339.92908 163.4
[M+K]+ 360.85842 139.7
[M+H-H2O]+ 304.89252 151.5
[M+HCOO]- 366.89346 162.9
[M+CH3COO]- 380.90911 209.8
[M+Na-2H]- 342.86993 151.2
[M]+ 321.89471 178.8
[M]- 321.89581 178.8
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.