CID 9588384

Ethanimidamide, n-hydroxy-2-((4-(methylthio)phenyl)thio)-, monohydrochloride

Structural Information

Molecular Formula
C9H12N2OS2
SMILES
CSC1=CC=C(C=C1)SC/C(=N\O)/N
InChI
InChI=1S/C9H12N2OS2/c1-13-7-2-4-8(5-3-7)14-6-9(10)11-12/h2-5,12H,6H2,1H3,(H2,10,11)
InChIKey
HLOHCEIERMWXLS-UHFFFAOYSA-N
Compound name
N'-hydroxy-2-(4-methylsulfanylphenyl)sulfanylethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

228.03911 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.04639 145.7
[M+Na]+ 251.02833 152.1
[M-H]- 227.03183 148.2
[M+NH4]+ 246.07293 163.4
[M+K]+ 267.00227 147.0
[M+H-H2O]+ 211.03637 138.9
[M+HCOO]- 273.03731 159.3
[M+CH3COO]- 287.05296 191.4
[M+Na-2H]- 249.01378 146.6
[M]+ 228.03856 146.1
[M]- 228.03966 146.1
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.