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]+ 190.13388 142.5
[M+Na]+ 212.11582 150.6
[M-H]- 188.11932 143.0
[M+NH4]+ 207.16042 161.3
[M+K]+ 228.08976 146.8
[M+H-H2O]+ 172.12386 135.4
[M+HCOO]- 234.12480 162.8
[M+CH3COO]- 248.14045 184.3
[M+Na-2H]- 210.10127 147.1
[M]+ 189.12605 140.8
[M]- 189.12715 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.