CID 43810818

2-(morpholin-4-yl)-1h-1,3-benzodiazol-5-amine

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

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.124036 146.9
[M+Na]+ 241.105978 154.9
[M-H]- 217.109484 149.4
[M+NH4]+ 236.150583 161.4
[M+K]+ 257.079918 151.1
[M+H-H2O]+ 201.114020 138.0
[M+HCOO]- 263.114961 164.2
[M+CH3COO]- 277.130611 158.2
[M+Na-2H]- 239.091426 152.9
[M]+ 218.11621142 142.6
[M]- 218.11730858 142.6
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