CID 3685650

2-chloro-4-nitrobenzhydrazide

Structural Information

Molecular Formula
C7H6ClN3O3
SMILES
C1=CC(=C(C=C1[N+](=O)[O-])Cl)C(=O)NN
InChI
InChI=1S/C7H6ClN3O3/c8-6-3-4(11(13)14)1-2-5(6)7(12)10-9/h1-3H,9H2,(H,10,12)
InChIKey
XLDHQBNLMQYVBC-UHFFFAOYSA-N
Compound name
2-chloro-4-nitrobenzohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

215.00977 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.01705 140.2
[M+Na]+ 237.99899 147.7
[M-H]- 214.00249 143.6
[M+NH4]+ 233.04359 157.9
[M+K]+ 253.97293 140.7
[M+H-H2O]+ 198.00703 139.8
[M+HCOO]- 260.00797 162.8
[M+CH3COO]- 274.02362 182.7
[M+Na-2H]- 235.98444 146.7
[M]+ 215.00922 138.5
[M]- 215.01032 138.5
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