CID 9648268

17665-59-7

Structural Information

Molecular Formula
C8H10N2O2S
SMILES
C1=CC=C(C=C1)S(=O)C/C(=N/O)/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

0
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 140.3
[M+Na]+ 221.03552 146.3
[M-H]- 197.03902 143.4
[M+NH4]+ 216.08012 158.7
[M+K]+ 237.00946 143.6
[M+H-H2O]+ 181.04356 133.6
[M+HCOO]- 243.04450 159.8
[M+CH3COO]- 257.06015 184.7
[M+Na-2H]- 219.02097 143.1
[M]+ 198.04575 139.4
[M]- 198.04685 139.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.