CID 9570608

Formaldehyde, nitro-, (p-chlorophenyl)hydrazone

Structural Information

Molecular Formula
C7H6ClN3O2
SMILES
C1=CC(=CC=C1N/N=C/[N+](=O)[O-])Cl
InChI
InChI=1S/C7H6ClN3O2/c8-6-1-3-7(4-2-6)10-9-5-11(12)13/h1-5,10H/b9-5+
InChIKey
QCINVSXGBZILCJ-WEVVVXLNSA-N
Compound name
4-chloro-N-[(E)-nitromethylideneamino]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

199.01485 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.022126 137.8
[M+Na]+ 222.004068 145.1
[M-H]- 198.007574 142.6
[M+NH4]+ 217.048673 156.9
[M+K]+ 237.978008 138.4
[M+H-H2O]+ 182.012110 136.8
[M+HCOO]- 244.013051 163.2
[M+CH3COO]- 258.028701 182.1
[M+Na-2H]- 219.989516 147.4
[M]+ 199.01430142 137.8
[M]- 199.01539858 137.8
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.