CID 3575057

25810-65-5

Structural Information

Molecular Formula
C11H15N3
SMILES
CC(C)C(C1=NC2=CC=CC=C2N1)N
InChI
InChI=1S/C11H15N3/c1-7(2)10(12)11-13-8-5-3-4-6-9(8)14-11/h3-7,10H,12H2,1-2H3,(H,13,14)
InChIKey
JDPVJORLNSVLOK-UHFFFAOYSA-N
Compound name
1-(1H-benzimidazol-2-yl)-2-methylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

189.1266 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.133876 142.5
[M+Na]+ 212.115818 150.6
[M-H]- 188.119324 143.0
[M+NH4]+ 207.160423 161.3
[M+K]+ 228.089758 146.8
[M+H-H2O]+ 172.123860 135.4
[M+HCOO]- 234.124801 162.8
[M+CH3COO]- 248.140451 184.3
[M+Na-2H]- 210.101266 147.1
[M]+ 189.12605142 140.8
[M]- 189.12714858 140.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.