CID 37544

36837-45-3

Structural Information

Molecular Formula
C15H15N5O
SMILES
C1=CC=C2C(=C1)N=CN2CNC3=CC=C(C=C3)C(=O)NN
InChI
InChI=1S/C15H15N5O/c16-19-15(21)11-5-7-12(8-6-11)17-9-20-10-18-13-3-1-2-4-14(13)20/h1-8,10,17H,9,16H2,(H,19,21)
InChIKey
GQURSSJLUKANDK-UHFFFAOYSA-N
Compound name
4-(benzimidazol-1-ylmethylamino)benzohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.12766 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.13494 163.0
[M+Na]+ 304.11688 174.9
[M+NH4]+ 299.16148 170.1
[M+K]+ 320.09082 170.3
[M-H]- 280.12038 167.5
[M+Na-2H]- 302.10233 171.2
[M]+ 281.12711 165.7
[M]- 281.12821 165.7
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.