CID 3087738

Thiazolidine, 2-(4-fluorophenyl)-5-methyl-

Structural Information

Molecular Formula
C10H12FNS
SMILES
CC1CNC(S1)C2=CC=C(C=C2)F
InChI
InChI=1S/C10H12FNS/c1-7-6-12-10(13-7)8-2-4-9(11)5-3-8/h2-5,7,10,12H,6H2,1H3
InChIKey
OZQOPXFNKKAFOI-UHFFFAOYSA-N
Compound name
2-(4-fluorophenyl)-5-methyl-1,3-thiazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.06744 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.074716 139.5
[M+Na]+ 220.056658 148.0
[M-H]- 196.060164 142.6
[M+NH4]+ 215.101263 159.6
[M+K]+ 236.030598 143.5
[M+H-H2O]+ 180.064700 132.6
[M+HCOO]- 242.065641 154.4
[M+CH3COO]- 256.081291 152.0
[M+Na-2H]- 218.042106 139.5
[M]+ 197.06689142 136.1
[M]- 197.06798858 136.1
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.