CID 208406

32081-51-9

Structural Information

Molecular Formula
C11H10N2OS2
SMILES
C1=CC=C(C=C1)SC(C2=NC=CS2)C(=O)N
InChI
InChI=1S/C11H10N2OS2/c12-10(14)9(11-13-6-7-15-11)16-8-4-2-1-3-5-8/h1-7,9H,(H2,12,14)
InChIKey
REPXMWRBOBUUCW-UHFFFAOYSA-N
Compound name
2-phenylsulfanyl-2-(1,3-thiazol-2-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

250.02345 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.03073 152.6
[M+Na]+ 273.01267 160.3
[M-H]- 249.01617 157.6
[M+NH4]+ 268.05727 170.1
[M+K]+ 288.98661 155.4
[M+H-H2O]+ 233.02071 145.8
[M+HCOO]- 295.02165 165.6
[M+CH3COO]- 309.03730 164.2
[M+Na-2H]- 270.99812 152.1
[M]+ 250.02290 153.2
[M]- 250.02400 153.2
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.