CID 24261834

4-(4-phenyl-1,3-thiazol-2-yl)piperidine hydrochloride

Structural Information

Molecular Formula
C14H16N2S
SMILES
C1CNCCC1C2=NC(=CS2)C3=CC=CC=C3
InChI
InChI=1S/C14H16N2S/c1-2-4-11(5-3-1)13-10-17-14(16-13)12-6-8-15-9-7-12/h1-5,10,12,15H,6-9H2
InChIKey
AWDWQARJWVPBDG-UHFFFAOYSA-N
Compound name
4-phenyl-2-piperidin-4-yl-1,3-thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

50
Patents

244.10342 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.11070 153.9
[M+Na]+ 267.09264 160.3
[M-H]- 243.09614 159.3
[M+NH4]+ 262.13724 170.0
[M+K]+ 283.06658 154.7
[M+H-H2O]+ 227.10068 145.7
[M+HCOO]- 289.10162 167.5
[M+CH3COO]- 303.11727 164.7
[M+Na-2H]- 265.07809 154.5
[M]+ 244.10287 149.1
[M]- 244.10397 149.1
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

patents stripe