CID 83682549

2825008-36-2

Structural Information

Molecular Formula
C8H10N2S
SMILES
C1CNCC=C1C2=CN=CS2
InChI
InChI=1S/C8H10N2S/c1-3-9-4-2-7(1)8-5-10-6-11-8/h1,5-6,9H,2-4H2
InChIKey
UOMHIVOWENCAEZ-UHFFFAOYSA-N
Compound name
5-(1,2,3,6-tetrahydropyridin-4-yl)-1,3-thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

166.05647 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.063746 132.8
[M+Na]+ 189.045688 140.5
[M-H]- 165.049194 135.5
[M+NH4]+ 184.090293 152.2
[M+K]+ 205.019628 136.9
[M+H-H2O]+ 149.053730 125.8
[M+HCOO]- 211.054671 148.2
[M+CH3COO]- 225.070321 145.3
[M+Na-2H]- 187.031136 135.5
[M]+ 166.05592142 129.4
[M]- 166.05701858 129.4
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

No patent data available for this compound.