CID 6510099

1h-benzimidazol-2-amine, n-(1-ethyl-2-pyrrolidinylidene)-

Structural Information

Molecular Formula
C13H16N4
SMILES
CCN\1CCC/C1=N/C2=NC3=CC=CC=C3N2
InChI
InChI=1S/C13H16N4/c1-2-17-9-5-8-12(17)16-13-14-10-6-3-4-7-11(10)15-13/h3-4,6-7H,2,5,8-9H2,1H3,(H,14,15)/b16-12-
InChIKey
WQNAZHNLADXFBU-VBKFSLOCSA-N
Compound name
(Z)-N-(1H-benzimidazol-2-yl)-1-ethylpyrrolidin-2-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

228.1375 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.144776 151.0
[M+Na]+ 251.126718 159.7
[M-H]- 227.130224 155.1
[M+NH4]+ 246.171323 169.5
[M+K]+ 267.100658 155.0
[M+H-H2O]+ 211.134760 142.0
[M+HCOO]- 273.135701 173.1
[M+CH3COO]- 287.151351 163.3
[M+Na-2H]- 249.112166 155.0
[M]+ 228.13695142 149.7
[M]- 228.13804858 149.7
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.