CID 211655

3,4-diphenyl-4-hydroxy-2-thiazolidinethione

Structural Information

Molecular Formula
C15H13NOS2
SMILES
C1C(N(C(=S)S1)C2=CC=CC=C2)(C3=CC=CC=C3)O
InChI
InChI=1S/C15H13NOS2/c17-15(12-7-3-1-4-8-12)11-19-14(18)16(15)13-9-5-2-6-10-13/h1-10,17H,11H2
InChIKey
HYYHFBLMGPOIEO-UHFFFAOYSA-N
Compound name
4-hydroxy-3,4-diphenyl-1,3-thiazolidine-2-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

287.04385 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.05113 161.8
[M+Na]+ 310.03307 171.1
[M-H]- 286.03657 169.0
[M+NH4]+ 305.07767 180.0
[M+K]+ 326.00701 164.3
[M+H-H2O]+ 270.04111 155.7
[M+HCOO]- 332.04205 172.9
[M+CH3COO]- 346.05770 173.2
[M+Na-2H]- 308.01852 162.2
[M]+ 287.04330 161.0
[M]- 287.04440 161.0
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