CID 3009971

1h-benzimidazole-2-methanamine, n,5-dimethyl-a-phenyl-

Structural Information

Molecular Formula
C16H17N3
SMILES
CC1=CC2=C(C=C1)N=C(N2)C(C3=CC=CC=C3)NC
InChI
InChI=1S/C16H17N3/c1-11-8-9-13-14(10-11)19-16(18-13)15(17-2)12-6-4-3-5-7-12/h3-10,15,17H,1-2H3,(H,18,19)
InChIKey
GIXHEQYXNVXJQD-UHFFFAOYSA-N
Compound name
N-methyl-1-(6-methyl-1H-benzimidazol-2-yl)-1-phenylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

251.14224 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.14952 157.4
[M+Na]+ 274.13146 165.9
[M-H]- 250.13496 161.7
[M+NH4]+ 269.17606 173.8
[M+K]+ 290.10540 159.9
[M+H-H2O]+ 234.13950 148.9
[M+HCOO]- 296.14044 179.1
[M+CH3COO]- 310.15609 169.2
[M+Na-2H]- 272.11691 163.4
[M]+ 251.14169 157.0
[M]- 251.14279 157.0
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.