CID 148387

1-(4-chlorophenyl)-3-methyltriazene

Structural Information

Molecular Formula
C7H8ClN3
SMILES
CN=NNC1=CC=C(C=C1)Cl
InChI
InChI=1S/C7H8ClN3/c1-9-11-10-7-4-2-6(8)3-5-7/h2-5H,1H3,(H,9,10)
InChIKey
VIOUCROVGDHEKX-UHFFFAOYSA-N
Compound name
4-chloro-N-(methyldiazenyl)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.04068 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.047956 132.5
[M+Na]+ 192.029898 141.1
[M-H]- 168.033404 139.1
[M+NH4]+ 187.074503 154.5
[M+K]+ 208.003838 138.7
[M+H-H2O]+ 152.037940 126.6
[M+HCOO]- 214.038881 159.3
[M+CH3COO]- 228.054531 188.6
[M+Na-2H]- 190.015346 142.2
[M]+ 169.04013142 134.8
[M]- 169.04122858 134.8
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

No patent data available for this compound.