CID 16206151

2-cyclopentyl-1,3-thiazole

Structural Information

Molecular Formula
C8H11NS
SMILES
C1CCC(C1)C2=NC=CS2
InChI
InChI=1S/C8H11NS/c1-2-4-7(3-1)8-9-5-6-10-8/h5-7H,1-4H2
InChIKey
WOQYIBOZNROQES-UHFFFAOYSA-N
Compound name
2-cyclopentyl-1,3-thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

63
Patents

153.06122 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.068496 132.3
[M+Na]+ 176.050438 140.4
[M-H]- 152.053944 138.1
[M+NH4]+ 171.095043 156.2
[M+K]+ 192.024378 138.8
[M+H-H2O]+ 136.058480 126.4
[M+HCOO]- 198.059421 151.2
[M+CH3COO]- 212.075071 146.4
[M+Na-2H]- 174.035886 132.9
[M]+ 153.06067142 131.3
[M]- 153.06176858 131.3
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