CID 3024537

Thiazole, 4,5-dihydro-2-cyclopentyl-

Structural Information

Molecular Formula
C8H13NS
SMILES
C1CCC(C1)C2=NCCS2
InChI
InChI=1S/C8H13NS/c1-2-4-7(3-1)8-9-5-6-10-8/h7H,1-6H2
InChIKey
XCKMQTKKGKRKCW-UHFFFAOYSA-N
Compound name
2-cyclopentyl-4,5-dihydro-1,3-thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.07687 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.08415 134.2
[M+Na]+ 178.06609 141.3
[M-H]- 154.06959 139.6
[M+NH4]+ 173.11069 157.9
[M+K]+ 194.04003 139.9
[M+H-H2O]+ 138.07413 128.2
[M+HCOO]- 200.07507 151.7
[M+CH3COO]- 214.09072 147.7
[M+Na-2H]- 176.05154 133.8
[M]+ 155.07632 131.8
[M]- 155.07742 131.8
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.