CID 24261827

4-(4-ethyl-1,3-thiazol-2-yl)piperidine

Structural Information

Molecular Formula

C₁₀H₁₆N₂S

SMILES

CCC1=CSC(=N1)C2CCNCC2

InChI

InChI=1S/C10H16N2S/c1-2-9-7-13-10(12-9)8-3-5-11-6-4-8/h7-8,11H,2-6H2,1H3

InChIKey

SVCNHWZSBCOUFX-UHFFFAOYSA-N

Compound name

4-ethyl-2-piperidin-4-yl-1,3-thiazole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 16
Patents: 196.10342 Da
Monoisotopic Mass: 1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	197.110696	143.4
[M+Na]+	219.092638	149.9
[M-H]-	195.096144	145.7
[M+NH4]+	214.137243	161.8
[M+K]+	235.066578	146.1
[M+H-H2O]+	179.100680	136.2
[M+HCOO]-	241.101621	156.6
[M+CH3COO]-	255.117271	154.8
[M+Na-2H]-	217.078086	143.4
[M]+	196.10287142	139.6
[M]-	196.10396858	139.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe