CID 417238

N4,n4-dimethylbenzene-1,2,4-triamine

Structural Information

Molecular Formula
C8H13N3
SMILES
CN(C)C1=CC(=C(C=C1)N)N
InChI
InChI=1S/C8H13N3/c1-11(2)6-3-4-7(9)8(10)5-6/h3-5H,9-10H2,1-2H3
InChIKey
AEPYIICGYIUTCV-UHFFFAOYSA-N
Compound name
4-N,4-N-dimethylbenzene-1,2,4-triamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

83
Patents

151.11095 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.118226 132.0
[M+Na]+ 174.100168 139.4
[M-H]- 150.103674 136.8
[M+NH4]+ 169.144773 152.9
[M+K]+ 190.074108 138.3
[M+H-H2O]+ 134.108210 125.7
[M+HCOO]- 196.109151 159.2
[M+CH3COO]- 210.124801 187.5
[M+Na-2H]- 172.085616 137.2
[M]+ 151.11040142 129.3
[M]- 151.11149858 129.3
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