CID 43810818

832102-58-6

Structural Information

Molecular Formula

C₁₁H₁₄N₄O

SMILES

C1COCCN1C2=NC3=C(N2)C=C(C=C3)N

InChI

InChI=1S/C11H14N4O/c12-8-1-2-9-10(7-8)14-11(13-9)15-3-5-16-6-4-15/h1-2,7H,3-6,12H2,(H,13,14)

InChIKey

ATSINGARJSBJPD-UHFFFAOYSA-N

Compound name

2-morpholin-4-yl-3H-benzimidazol-5-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 218.11676 Da
Monoisotopic Mass: 0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	219.12404	147.4
[M+Na]+	241.10598	160.0
[M+NH4]+	236.15058	155.2
[M+K]+	257.07992	156.1
[M-H]-	217.10948	151.3
[M+Na-2H]-	239.09143	153.3
[M]+	218.11621	150.1
[M]-	218.11731	150.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe