CID 137943144

5-bromo-n'-hydroxy-1,3,4-thiadiazole-2-carboximidamide

Structural Information

Molecular Formula
C3H3BrN4OS
SMILES
C1(=NN=C(S1)Br)/C(=N/O)/N
InChI
InChI=1S/C3H3BrN4OS/c4-3-7-6-2(10-3)1(5)8-9/h9H,(H2,5,8)
InChIKey
MRUJTWQVZYBSCL-UHFFFAOYSA-N
Compound name
5-bromo-N'-hydroxy-1,3,4-thiadiazole-2-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.9211 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.92838 130.9
[M+Na]+ 244.91032 130.8
[M+NH4]+ 239.95492 134.6
[M+K]+ 260.88426 133.3
[M-H]- 220.91382 130.0
[M+Na-2H]- 242.89577 132.5
[M]+ 221.92055 129.4
[M]- 221.92165 129.4
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

No patent data available for this compound.