CID 15034538

1-tert-butyl-1h-1,3-benzodiazol-2-amine

Structural Information

Molecular Formula
C11H15N3
SMILES
CC(C)(C)N1C2=CC=CC=C2N=C1N
InChI
InChI=1S/C11H15N3/c1-11(2,3)14-9-7-5-4-6-8(9)13-10(14)12/h4-7H,1-3H3,(H2,12,13)
InChIKey
HDEFXNYIQDDCSW-UHFFFAOYSA-N
Compound name
1-tert-butylbenzimidazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

189.1266 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.133876 143.0
[M+Na]+ 212.115818 153.6
[M-H]- 188.119324 145.5
[M+NH4]+ 207.160423 163.2
[M+K]+ 228.089758 150.1
[M+H-H2O]+ 172.123860 136.4
[M+HCOO]- 234.124801 165.2
[M+CH3COO]- 248.140451 185.9
[M+Na-2H]- 210.101266 150.4
[M]+ 189.12605142 144.2
[M]- 189.12714858 144.2
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

patents stripe