CID 962388

637325-09-8

Structural Information

Molecular Formula
C19H22N2
SMILES
CC1=CC2=C(C=C1C)N(C=N2)CC3=CC=C(C=C3)C(C)C
InChI
InChI=1S/C19H22N2/c1-13(2)17-7-5-16(6-8-17)11-21-12-20-18-9-14(3)15(4)10-19(18)21/h5-10,12-13H,11H2,1-4H3
InChIKey
FUISTPWDJJENSI-UHFFFAOYSA-N
Compound name
5,6-dimethyl-1-[(4-propan-2-ylphenyl)methyl]benzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

278.17828 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.185556 168.1
[M+Na]+ 301.167498 178.4
[M-H]- 277.171004 173.9
[M+NH4]+ 296.212103 185.0
[M+K]+ 317.141438 172.5
[M+H-H2O]+ 261.175540 159.4
[M+HCOO]- 323.176481 189.1
[M+CH3COO]- 337.192131 180.4
[M+Na-2H]- 299.152946 170.5
[M]+ 278.17773142 171.8
[M]- 278.17882858 171.8
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

No patent data available for this compound.