CID 7387975

2-(2-methyl-1h-benzimidazol-1-yl)-n'-(3-phenyl-2-propenylidene)acetohydrazide

Structural Information

Molecular Formula
C19H18N4O
SMILES
CC1=NC2=CC=CC=C2N1CC(=O)N/N=C/C=C/C3=CC=CC=C3
InChI
InChI=1S/C19H18N4O/c1-15-21-17-11-5-6-12-18(17)23(15)14-19(24)22-20-13-7-10-16-8-3-2-4-9-16/h2-13H,14H2,1H3,(H,22,24)/b10-7+,20-13+
InChIKey
OBRIRPAPWWRYPO-ADCWSOHQSA-N
Compound name
2-(2-methylbenzimidazol-1-yl)-N-[(E)-[(E)-3-phenylprop-2-enylidene]amino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

318.14807 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.15535 175.6
[M+Na]+ 341.13729 183.5
[M-H]- 317.14079 182.1
[M+NH4]+ 336.18189 190.0
[M+K]+ 357.11123 177.3
[M+H-H2O]+ 301.14533 165.4
[M+HCOO]- 363.14627 201.0
[M+CH3COO]- 377.16192 212.7
[M+Na-2H]- 339.12274 181.3
[M]+ 318.14752 178.0
[M]- 318.14862 178.0
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.