CID 82007903

2-bromo-5-hydrazinylbenzoic acid hydrochloride

Structural Information

Molecular Formula
C7H7BrN2O2
SMILES
C1=CC(=C(C=C1NN)C(=O)O)Br
InChI
InChI=1S/C7H7BrN2O2/c8-6-2-1-4(10-9)3-5(6)7(11)12/h1-3,10H,9H2,(H,11,12)
InChIKey
DFJCKNRTRUXHGJ-UHFFFAOYSA-N
Compound name
2-bromo-5-hydrazinylbenzoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

229.96909 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.97637 138.8
[M+Na]+ 252.95831 149.2
[M-H]- 228.96181 143.5
[M+NH4]+ 248.00291 158.7
[M+K]+ 268.93225 137.6
[M+H-H2O]+ 212.96635 137.6
[M+HCOO]- 274.96729 160.6
[M+CH3COO]- 288.98294 188.6
[M+Na-2H]- 250.94376 145.0
[M]+ 229.96854 154.2
[M]- 229.96964 154.2
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