CID 43148777

1-(cyclopropylmethyl)-1h-1,3-benzodiazol-2-amine

Structural Information

Molecular Formula
C11H13N3
SMILES
C1CC1CN2C3=CC=CC=C3N=C2N
InChI
InChI=1S/C11H13N3/c12-11-13-9-3-1-2-4-10(9)14(11)7-8-5-6-8/h1-4,8H,5-7H2,(H2,12,13)
InChIKey
WWFYTACYBRMYFI-UHFFFAOYSA-N
Compound name
1-(cyclopropylmethyl)benzimidazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

187.11095 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.118226 142.1
[M+Na]+ 210.100168 154.1
[M-H]- 186.103674 148.0
[M+NH4]+ 205.144773 157.1
[M+K]+ 226.074108 148.5
[M+H-H2O]+ 170.108210 134.5
[M+HCOO]- 232.109151 166.3
[M+CH3COO]- 246.124801 155.4
[M+Na-2H]- 208.085616 148.8
[M]+ 187.11040142 144.8
[M]- 187.11149858 144.8
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