CID 3053957

Brn 0805240

Structural Information

Molecular Formula
C11H10ClN5O
SMILES
CC(=O)NNC1=NC(=CN=N1)C2=CC(=CC=C2)Cl
InChI
InChI=1S/C11H10ClN5O/c1-7(18)15-17-11-14-10(6-13-16-11)8-3-2-4-9(12)5-8/h2-6H,1H3,(H,15,18)(H,14,16,17)
InChIKey
MZBUMFFDKRQBPO-UHFFFAOYSA-N
Compound name
N'-[5-(3-chlorophenyl)-1,2,4-triazin-3-yl]acetohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

263.05737 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.06465 155.8
[M+Na]+ 286.04659 169.9
[M+NH4]+ 281.09119 162.7
[M+K]+ 302.02053 163.2
[M-H]- 262.05009 159.1
[M+Na-2H]- 284.03204 165.0
[M]+ 263.05682 158.9
[M]- 263.05792 158.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.