CID 170997595

5-bromo-1,3-thiazole-4-carbohydrazide

Structural Information

Molecular Formula
C4H4BrN3OS
SMILES
C1=NC(=C(S1)Br)C(=O)NN
InChI
InChI=1S/C4H4BrN3OS/c5-3-2(4(9)8-6)7-1-10-3/h1H,6H2,(H,8,9)
InChIKey
NZSKWMWHQYILLB-UHFFFAOYSA-N
Compound name
5-bromo-1,3-thiazole-4-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

220.92586 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.93314 128.8
[M+Na]+ 243.91508 141.2
[M-H]- 219.91858 134.2
[M+NH4]+ 238.95968 151.0
[M+K]+ 259.88902 129.7
[M+H-H2O]+ 203.92312 127.7
[M+HCOO]- 265.92406 147.6
[M+CH3COO]- 279.93971 184.7
[M+Na-2H]- 241.90053 133.7
[M]+ 220.92531 146.7
[M]- 220.92641 146.7
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.