CID 3009980

Phenyl-(1-phenylbenzimidazol-2-yl)methanamine

Structural Information

Molecular Formula
C20H17N3
SMILES
C1=CC=C(C=C1)C(C2=NC3=CC=CC=C3N2C4=CC=CC=C4)N
InChI
InChI=1S/C20H17N3/c21-19(15-9-3-1-4-10-15)20-22-17-13-7-8-14-18(17)23(20)16-11-5-2-6-12-16/h1-14,19H,21H2
InChIKey
WFYFFORJYKOGKE-UHFFFAOYSA-N
Compound name
phenyl-(1-phenylbenzimidazol-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

299.14224 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.149516 169.7
[M+Na]+ 322.131458 178.0
[M-H]- 298.134964 177.7
[M+NH4]+ 317.176063 183.8
[M+K]+ 338.105398 170.9
[M+H-H2O]+ 282.139500 159.5
[M+HCOO]- 344.140441 192.0
[M+CH3COO]- 358.156091 180.9
[M+Na-2H]- 320.116906 175.2
[M]+ 299.14169142 168.7
[M]- 299.14278858 168.7
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.