CID 3039569

50820-92-3

Structural Information

Molecular Formula
C19H23N3O
SMILES
CCN(CC)C1=CC=C(C=C1)C(C2=NC3=CC=CC=C3N2C)O
InChI
InChI=1S/C19H23N3O/c1-4-22(5-2)15-12-10-14(11-13-15)18(23)19-20-16-8-6-7-9-17(16)21(19)3/h6-13,18,23H,4-5H2,1-3H3
InChIKey
ULWCCPQNNXBOIA-UHFFFAOYSA-N
Compound name
[4-(diethylamino)phenyl]-(1-methylbenzimidazol-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

309.1841 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.19138 175.2
[M+Na]+ 332.17332 183.1
[M-H]- 308.17682 180.8
[M+NH4]+ 327.21792 190.0
[M+K]+ 348.14726 178.5
[M+H-H2O]+ 292.18136 165.9
[M+HCOO]- 354.18230 196.5
[M+CH3COO]- 368.19795 211.5
[M+Na-2H]- 330.15877 178.0
[M]+ 309.18355 178.7
[M]- 309.18465 178.7
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.