CID 5821911

Thiamethoxam

Structural Information

Molecular Formula
C8H10ClN5O3S
SMILES
CN\1COCN(/C1=N/[N+](=O)[O-])CC2=CN=C(S2)Cl
InChI
InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+
InChIKey
NWWZPOKUUAIXIW-DHZHZOJOSA-N
Compound name
(NE)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,5-oxadiazinan-4-ylidene]nitramide
Related CIDs

2D Structure

compound 2d structure
8
Annotation Hits

1024
References

51377
Patents

291.0193 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.02658 161.2
[M+Na]+ 314.00852 168.4
[M-H]- 290.01202 166.0
[M+NH4]+ 309.05312 173.8
[M+K]+ 329.98246 161.9
[M+H-H2O]+ 274.01656 157.6
[M+HCOO]- 336.01750 173.2
[M+CH3COO]- 350.03315 193.6
[M+Na-2H]- 311.99397 164.7
[M]+ 291.01875 161.3
[M]- 291.01985 161.3
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.