CID 4123378

2-(benzenesulfinyl)-n'-hydroxyethanimidamide

Structural Information

Molecular Formula
C8H10N2O2S
SMILES
C1=CC=C(C=C1)S(=O)CC(=NO)N
InChI
InChI=1S/C8H10N2O2S/c9-8(10-11)6-13(12)7-4-2-1-3-5-7/h1-5,11H,6H2,(H2,9,10)
InChIKey
TVKYGAOWCSLWRX-UHFFFAOYSA-N
Compound name
2-(benzenesulfinyl)-N'-hydroxyethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

198.0463 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.05358 140.4
[M+Na]+ 221.03552 149.4
[M+NH4]+ 216.08012 147.9
[M+K]+ 237.00946 143.1
[M-H]- 197.03902 142.2
[M+Na-2H]- 219.02097 145.6
[M]+ 198.04575 142.3
[M]- 198.04685 142.3
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

patents stripe