CID 24279096

921145-11-1

Structural Information

Molecular Formula

C₆H₁₀N₂S

SMILES

CC1=CN=C(S1)CCN

InChI

InChI=1S/C6H10N2S/c1-5-4-8-6(9-5)2-3-7/h4H,2-3,7H2,1H3

InChIKey

OHKVIMXWAPLQHP-UHFFFAOYSA-N

Compound name

2-(5-methyl-1,3-thiazol-2-yl)ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 13
Patents: 142.05647 Da
Monoisotopic Mass: 0.7
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]+	143.063746	127.1
[M+Na]+	165.045688	136.4
[M-H]-	141.049194	129.6
[M+NH4]+	160.090293	149.6
[M+K]+	181.019628	134.0
[M+H-H2O]+	125.053730	121.2
[M+HCOO]-	187.054671	147.2
[M+CH3COO]-	201.070321	174.1
[M+Na-2H]-	163.031136	129.6
[M]+	142.05592142	128.1
[M]-	142.05701858	128.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe