CID 2735737

2-chloro-4-hydrazinylbenzoic acid hydrochloride

Structural Information

Molecular Formula
C7H7ClN2O2
SMILES
C1=CC(=C(C=C1NN)Cl)C(=O)O
InChI
InChI=1S/C7H7ClN2O2/c8-6-3-4(10-9)1-2-5(6)7(11)12/h1-3,10H,9H2,(H,11,12)
InChIKey
OPDFEMWFKZVKSH-UHFFFAOYSA-N
Compound name
2-chloro-4-hydrazinylbenzoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

52
Patents

186.0196 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.02688 135.1
[M+Na]+ 209.00882 143.8
[M-H]- 185.01232 137.6
[M+NH4]+ 204.05342 154.5
[M+K]+ 224.98276 140.0
[M+H-H2O]+ 169.01686 130.6
[M+HCOO]- 231.01780 155.4
[M+CH3COO]- 245.03345 182.2
[M+Na-2H]- 206.99427 140.2
[M]+ 186.01905 134.3
[M]- 186.02015 134.3
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