CID 3033758

96224-19-0

Structural Information

Molecular Formula
C15H19N3
SMILES
CCN1C=NC2=C1CCC(C2)NC3=CC=CC=C3
InChI
InChI=1S/C15H19N3/c1-2-18-11-16-14-10-13(8-9-15(14)18)17-12-6-4-3-5-7-12/h3-7,11,13,17H,2,8-10H2,1H3
InChIKey
DMXKNQMUGNCUBV-UHFFFAOYSA-N
Compound name
1-ethyl-N-phenyl-4,5,6,7-tetrahydrobenzimidazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.1579 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.16518 155.7
[M+Na]+ 264.14712 162.2
[M-H]- 240.15062 160.1
[M+NH4]+ 259.19172 172.9
[M+K]+ 280.12106 157.4
[M+H-H2O]+ 224.15516 146.6
[M+HCOO]- 286.15610 175.9
[M+CH3COO]- 300.17175 167.0
[M+Na-2H]- 262.13257 160.6
[M]+ 241.15735 152.9
[M]- 241.15845 152.9
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

patents stripe