CID 62542320

4-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]piperidine hydrobromide

Structural Information

Molecular Formula
C15H18N2OS
SMILES
COC1=CC=CC=C1C2=CSC(=N2)C3CCNCC3
InChI
InChI=1S/C15H18N2OS/c1-18-14-5-3-2-4-12(14)13-10-19-15(17-13)11-6-8-16-9-7-11/h2-5,10-11,16H,6-9H2,1H3
InChIKey
OWRIBNXERSFIDU-UHFFFAOYSA-N
Compound name
4-(2-methoxyphenyl)-2-piperidin-4-yl-1,3-thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

274.11398 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.12126 162.0
[M+Na]+ 297.10320 168.7
[M-H]- 273.10670 167.6
[M+NH4]+ 292.14780 177.0
[M+K]+ 313.07714 163.3
[M+H-H2O]+ 257.11124 153.7
[M+HCOO]- 319.11218 175.4
[M+CH3COO]- 333.12783 172.5
[M+Na-2H]- 295.08865 161.5
[M]+ 274.11343 159.4
[M]- 274.11453 159.4
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