CID 5342787

(e)-n'-(2,6-dichlorobenzylidene)-3-methyl-1h-pyrazole-5-carbohydrazide

Structural Information

Molecular Formula
C12H10Cl2N4O
SMILES
CC1=CC(=NN1)C(=O)N/N=C/C2=C(C=CC=C2Cl)Cl
InChI
InChI=1S/C12H10Cl2N4O/c1-7-5-11(17-16-7)12(19)18-15-6-8-9(13)3-2-4-10(8)14/h2-6H,1H3,(H,16,17)(H,18,19)/b15-6+
InChIKey
GWRQCZYRXNULEX-GIDUJCDVSA-N
Compound name
N-[(E)-(2,6-dichlorophenyl)methylideneamino]-5-methyl-1H-pyrazole-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

296.02316 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.030436 165.6
[M+Na]+ 319.012378 175.3
[M-H]- 295.015884 169.5
[M+NH4]+ 314.056983 180.9
[M+K]+ 334.986318 168.5
[M+H-H2O]+ 279.020420 157.8
[M+HCOO]- 341.021361 180.5
[M+CH3COO]- 355.037011 202.6
[M+Na-2H]- 316.997826 168.2
[M]+ 296.02261142 167.8
[M]- 296.02370858 167.8
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.