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

73
Patents

153.06122 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.06850 132.3
[M+Na]+ 176.05044 140.4
[M-H]- 152.05394 138.1
[M+NH4]+ 171.09504 156.2
[M+K]+ 192.02438 138.8
[M+H-H2O]+ 136.05848 126.4
[M+HCOO]- 198.05942 151.2
[M+CH3COO]- 212.07507 146.4
[M+Na-2H]- 174.03589 132.9
[M]+ 153.06067 131.3
[M]- 153.06177 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