CID 117215781

2490398-58-6

Structural Information

Molecular Formula

C₆H₁₁N₃S

SMILES

CN(C)CC1=NSC(=C1)N

InChI

InChI=1S/C6H11N3S/c1-9(2)4-5-3-6(7)10-8-5/h3H,4,7H2,1-2H3

InChIKey

OCFKMLYKEOKWCY-UHFFFAOYSA-N

Compound name

3-[(dimethylamino)methyl]-1,2-thiazol-5-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 157.06737 Da
Monoisotopic Mass: 0.5
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]+	158.07465	132.1
[M+Na]+	180.05659	141.4
[M+NH4]+	175.10119	140.9
[M+K]+	196.03053	136.3
[M-H]-	156.06009	134.6
[M+Na-2H]-	178.04204	137.2
[M]+	157.06682	134.3
[M]-	157.06792	134.3

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.