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 156.3
[M+Na]+ 286.04659 165.1
[M-H]- 262.05009 159.2
[M+NH4]+ 281.09119 168.9
[M+K]+ 302.02053 159.8
[M+H-H2O]+ 246.05463 146.9
[M+HCOO]- 308.05557 174.4
[M+CH3COO]- 322.07122 198.5
[M+Na-2H]- 284.03204 164.0
[M]+ 263.05682 157.3
[M]- 263.05792 157.3
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.