CID 155821266

2357373-66-9

Structural Information

Molecular Formula
C8H11NOS
SMILES
CC1=NC(=CS1)C2CC(C2)O
InChI
InChI=1S/C8H11NOS/c1-5-9-8(4-11-5)6-2-7(10)3-6/h4,6-7,10H,2-3H2,1H3
InChIKey
FBROIJMRDFZRRE-UHFFFAOYSA-N
Compound name
3-(2-methyl-1,3-thiazol-4-yl)cyclobutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.05614 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.063416 128.2
[M+Na]+ 192.045358 135.4
[M-H]- 168.048864 132.7
[M+NH4]+ 187.089963 142.8
[M+K]+ 208.019298 135.8
[M+H-H2O]+ 152.053400 117.3
[M+HCOO]- 214.054341 144.3
[M+CH3COO]- 228.069991 178.2
[M+Na-2H]- 190.030806 129.1
[M]+ 169.05559142 137.3
[M]- 169.05668858 137.3
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

No patent data available for this compound.