CID 9588386

2-((4-(ethylthio)phenyl)thio)-n-hydroxyethanimidamide hydrochloride

Structural Information

Molecular Formula
C10H14N2OS2
SMILES
CCSC1=CC=C(C=C1)SC/C(=N\O)/N
InChI
InChI=1S/C10H14N2OS2/c1-2-14-8-3-5-9(6-4-8)15-7-10(11)12-13/h3-6,13H,2,7H2,1H3,(H2,11,12)
InChIKey
AHVVORZUWDYEEH-UHFFFAOYSA-N
Compound name
2-(4-ethylsulfanylphenyl)sulfanyl-N'-hydroxyethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

242.05475 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.06203 150.1
[M+Na]+ 265.04397 159.0
[M+NH4]+ 260.08857 158.4
[M+K]+ 281.01791 149.6
[M-H]- 241.04747 153.0
[M+Na-2H]- 263.02942 154.7
[M]+ 242.05420 152.9
[M]- 242.05530 152.9
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.