CID 65596906

2-[1-(2-cyclopropylethyl)-1h-1,3-benzodiazol-2-yl]ethan-1-amine dihydrochloride

Structural Information

Molecular Formula
C14H19N3
SMILES
C1CC1CCN2C3=CC=CC=C3N=C2CCN
InChI
InChI=1S/C14H19N3/c15-9-7-14-16-12-3-1-2-4-13(12)17(14)10-8-11-5-6-11/h1-4,11H,5-10,15H2
InChIKey
JIXDDKPKMMAIMC-UHFFFAOYSA-N
Compound name
2-[1-(2-cyclopropylethyl)benzimidazol-2-yl]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

229.1579 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.165176 154.7
[M+Na]+ 252.147118 165.4
[M-H]- 228.150624 160.1
[M+NH4]+ 247.191723 168.1
[M+K]+ 268.121058 159.1
[M+H-H2O]+ 212.155160 146.6
[M+HCOO]- 274.156101 178.0
[M+CH3COO]- 288.171751 166.8
[M+Na-2H]- 250.132566 159.9
[M]+ 229.15735142 158.4
[M]- 229.15844858 158.4
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.