CID 129320286

(z)-n-hydroxy-2-(4-hydroxyphenyl)acetimidothioate

Structural Information

Molecular Formula
C8H8NO2S
SMILES
C1=CC(=CC=C1CC(=S)N[O-])O
InChI
InChI=1S/C8H8NO2S/c10-7-3-1-6(2-4-7)5-8(12)9-11/h1-4H,5H2,(H2-,9,10,11,12)/q-1
InChIKey
AZKWQAUWSDUYSH-UHFFFAOYSA-N
Compound name
2-(4-hydroxyphenyl)-N-oxidoethanethioamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

182.02757 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.03485 135.8
[M+Na]+ 205.01679 146.1
[M+NH4]+ 200.06139 143.4
[M+K]+ 220.99073 140.0
[M-H]- 181.02029 137.1
[M+Na-2H]- 203.00224 140.4
[M]+ 182.02702 137.5
[M]- 182.02812 137.5
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.