CID 62923957

(4-cyclohexyl-1,3-thiazol-2-yl)methanol

Structural Information

Molecular Formula
C10H15NOS
SMILES
C1CCC(CC1)C2=CSC(=N2)CO
InChI
InChI=1S/C10H15NOS/c12-6-10-11-9(7-13-10)8-4-2-1-3-5-8/h7-8,12H,1-6H2
InChIKey
XMQZBUQWPJCUCI-UHFFFAOYSA-N
Compound name
(4-cyclohexyl-1,3-thiazol-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.08743 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.094706 142.9
[M+Na]+ 220.076648 149.2
[M-H]- 196.080154 146.6
[M+NH4]+ 215.121253 162.5
[M+K]+ 236.050588 146.0
[M+H-H2O]+ 180.084690 136.6
[M+HCOO]- 242.085631 157.6
[M+CH3COO]- 256.101281 154.8
[M+Na-2H]- 218.062096 143.2
[M]+ 197.08688142 140.1
[M]- 197.08797858 140.1
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.