CID 64309128

4-cyclopropyl-1,3-thiazole-2-thiol

Structural Information

Molecular Formula
C6H7NS2
SMILES
C1CC1C2=CSC(=S)N2
InChI
InChI=1S/C6H7NS2/c8-6-7-5(3-9-6)4-1-2-4/h3-4H,1-2H2,(H,7,8)
InChIKey
QIENDHTVOUQYPT-UHFFFAOYSA-N
Compound name
4-cyclopropyl-3H-1,3-thiazole-2-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

157.002 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.00928 133.1
[M+Na]+ 179.99122 145.5
[M+NH4]+ 175.03582 143.3
[M+K]+ 195.96516 138.6
[M-H]- 155.99472 142.4
[M+Na-2H]- 177.97667 140.4
[M]+ 157.00145 139.4
[M]- 157.00255 139.4
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