CID 10130527

Desnitro-imidacloprid

Structural Information

Molecular Formula
C9H11ClN4
SMILES
C1CN(C(=N1)N)CC2=CN=C(C=C2)Cl
InChI
InChI=1S/C9H11ClN4/c10-8-2-1-7(5-13-8)6-14-4-3-12-9(14)11/h1-2,5H,3-4,6H2,(H2,11,12)
InChIKey
UEQZFAGVRGWPDK-UHFFFAOYSA-N
Compound name
1-[(6-chloro-3-pyridinyl)methyl]-4,5-dihydroimidazol-2-amine
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

11
References

101
Patents

210.06723 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.07451 144.5
[M+Na]+ 233.05645 153.9
[M-H]- 209.05995 146.7
[M+NH4]+ 228.10105 161.4
[M+K]+ 249.03039 149.0
[M+H-H2O]+ 193.06449 135.8
[M+HCOO]- 255.06543 161.5
[M+CH3COO]- 269.08108 156.7
[M+Na-2H]- 231.04190 148.9
[M]+ 210.06668 143.6
[M]- 210.06778 143.6
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.