CID 3000583

2-(2-hydroxyanilino)-n-phenyl-2-thioxo-acetamide

Structural Information

Molecular Formula
C14H12N2O2S
SMILES
C1=CC=C(C=C1)NC(=O)C(=S)NC2=CC=CC=C2O
InChI
InChI=1S/C14H12N2O2S/c17-12-9-5-4-8-11(12)16-14(19)13(18)15-10-6-2-1-3-7-10/h1-9,17H,(H,15,18)(H,16,19)
InChIKey
GSHYRPXNOSOLCL-UHFFFAOYSA-N
Compound name
2-(2-hydroxyanilino)-N-phenyl-2-sulfanylideneacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.06195 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.06923 159.9
[M+Na]+ 295.05117 165.5
[M-H]- 271.05467 165.2
[M+NH4]+ 290.09577 175.0
[M+K]+ 311.02511 160.4
[M+H-H2O]+ 255.05921 152.4
[M+HCOO]- 317.06015 178.4
[M+CH3COO]- 331.07580 196.6
[M+Na-2H]- 293.03662 162.8
[M]+ 272.06140 158.3
[M]- 272.06250 158.3
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

No patent data available for this compound.