CID 6399255

Oximino oxamyl

Structural Information

Molecular Formula
C5H10N2O2S
SMILES
CN(C)C(=O)/C(=N/O)/SC
InChI
InChI=1S/C5H10N2O2S/c1-7(2)5(8)4(6-9)10-3/h9H,1-3H3/b6-4-
InChIKey
KIDWGGCIROEJJW-XQRVVYSFSA-N
Compound name
methyl (1Z)-2-(dimethylamino)-N-hydroxy-2-oxoethanimidothioate
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

0
References

76
Patents

162.0463 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.053576 134.2
[M+Na]+ 185.035518 140.4
[M-H]- 161.039024 136.3
[M+NH4]+ 180.080123 155.5
[M+K]+ 201.009458 141.1
[M+H-H2O]+ 145.043560 128.3
[M+HCOO]- 207.044501 153.9
[M+CH3COO]- 221.060151 182.3
[M+Na-2H]- 183.020966 135.8
[M]+ 162.04575142 136.6
[M]- 162.04684858 136.6
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

patents stripe