CID 457450

Chembl311563

Structural Information

Molecular Formula
C11H12N4O
SMILES
C1=CC2=C(C=CC(=C2)NCC(=O)NN)N=C1
InChI
InChI=1S/C11H12N4O/c12-15-11(16)7-14-9-3-4-10-8(6-9)2-1-5-13-10/h1-6,14H,7,12H2,(H,15,16)
InChIKey
KPSSQAWXCGTTJC-UHFFFAOYSA-N
Compound name
2-(quinolin-6-ylamino)acetohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

10
Patents

216.1011 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.10838 144.0
[M+Na]+ 239.09032 150.4
[M-H]- 215.09382 146.7
[M+NH4]+ 234.13492 160.9
[M+K]+ 255.06426 147.1
[M+H-H2O]+ 199.09836 136.2
[M+HCOO]- 261.09930 168.4
[M+CH3COO]- 275.11495 194.4
[M+Na-2H]- 237.07577 153.0
[M]+ 216.10055 141.3
[M]- 216.10165 141.3
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.