CID 121205226

Ethyl 3-chloro-6-cyclopropylpyridazine-4-carboxylate

Structural Information

Molecular Formula
C10H11ClN2O2
SMILES
CCOC(=O)C1=CC(=NN=C1Cl)C2CC2
InChI
InChI=1S/C10H11ClN2O2/c1-2-15-10(14)7-5-8(6-3-4-6)12-13-9(7)11/h5-6H,2-4H2,1H3
InChIKey
ITHFDWNDIYOINO-UHFFFAOYSA-N
Compound name
ethyl 3-chloro-6-cyclopropylpyridazine-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

226.0509 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.05818 150.6
[M+Na]+ 249.04012 161.6
[M-H]- 225.04362 155.3
[M+NH4]+ 244.08472 162.4
[M+K]+ 265.01406 156.9
[M+H-H2O]+ 209.04816 142.8
[M+HCOO]- 271.04910 167.8
[M+CH3COO]- 285.06475 190.6
[M+Na-2H]- 247.02557 155.0
[M]+ 226.05035 156.5
[M]- 226.05145 156.5
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

patents stripe