CID 583784

4-cyanophenylhydrazine hydrochloride

Structural Information

Molecular Formula
C7H7N3
SMILES
C1=CC(=CC=C1C#N)NN
InChI
InChI=1S/C7H7N3/c8-5-6-1-3-7(10-9)4-2-6/h1-4,10H,9H2
InChIKey
DZUUSHCOMPROCJ-UHFFFAOYSA-N
Compound name
4-hydrazinylbenzonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

1060
Patents

133.064 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.07128 129.2
[M+Na]+ 156.05322 138.5
[M-H]- 132.05672 132.2
[M+NH4]+ 151.09782 148.0
[M+K]+ 172.02716 135.9
[M+H-H2O]+ 116.06126 116.9
[M+HCOO]- 178.06220 151.6
[M+CH3COO]- 192.07785 189.5
[M+Na-2H]- 154.03867 136.3
[M]+ 133.06345 121.3
[M]- 133.06455 121.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe