CID 202955

13578-58-0

Structural Information

Molecular Formula

C₅H₁₀N₂S

SMILES

CCNC1=NCCS1

InChI

InChI=1S/C5H10N2S/c1-2-6-5-7-3-4-8-5/h2-4H2,1H3,(H,6,7)

InChIKey

UANNUCWLFACGGT-UHFFFAOYSA-N

Compound name

N-ethyl-4,5-dihydro-1,3-thiazol-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 10
Patents: 130.05647 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]+	131.063746	124.6
[M+Na]+	153.045688	132.4
[M-H]-	129.049194	127.1
[M+NH4]+	148.090293	147.6
[M+K]+	169.019628	131.1
[M+H-H2O]+	113.053730	118.6
[M+HCOO]-	175.054671	144.2
[M+CH3COO]-	189.070321	170.4
[M+Na-2H]-	151.031136	128.3
[M]+	130.05592142	124.3
[M]-	130.05701858	124.3

Literature stripe

literature stripe

Patent stripe

patents stripe