CID 43148798

63261-04-1

Structural Information

Molecular Formula
C15H15N3
SMILES
CC(C1=CC=CC=C1)N2C3=CC=CC=C3N=C2N
InChI
InChI=1S/C15H15N3/c1-11(12-7-3-2-4-8-12)18-14-10-6-5-9-13(14)17-15(18)16/h2-11H,1H3,(H2,16,17)
InChIKey
MIHMSHYCJPFPER-UHFFFAOYSA-N
Compound name
1-(1-phenylethyl)benzimidazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

237.1266 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.13388 153.3
[M+Na]+ 260.11582 162.7
[M-H]- 236.11932 158.6
[M+NH4]+ 255.16042 170.7
[M+K]+ 276.08976 157.4
[M+H-H2O]+ 220.12386 144.7
[M+HCOO]- 282.12480 176.3
[M+CH3COO]- 296.14045 165.9
[M+Na-2H]- 258.10127 159.2
[M]+ 237.12605 153.4
[M]- 237.12715 153.4
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.