CID 503929

4,5-dimethyl-n-phenyl-1h-imidazol-1-amine

Structural Information

Molecular Formula
C11H13N3
SMILES
CC1=C(N(C=N1)NC2=CC=CC=C2)C
InChI
InChI=1S/C11H13N3/c1-9-10(2)14(8-12-9)13-11-6-4-3-5-7-11/h3-8,13H,1-2H3
InChIKey
MFDCGDVOOOUFQR-UHFFFAOYSA-N
Compound name
4,5-dimethyl-N-phenylimidazol-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

13
Patents

187.11095 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.11823 139.9
[M+Na]+ 210.10017 148.9
[M-H]- 186.10367 144.6
[M+NH4]+ 205.14477 158.8
[M+K]+ 226.07411 145.5
[M+H-H2O]+ 170.10821 131.7
[M+HCOO]- 232.10915 164.6
[M+CH3COO]- 246.12480 185.3
[M+Na-2H]- 208.08562 146.1
[M]+ 187.11040 139.9
[M]- 187.11150 139.9
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