CID 3819305

N-(4-ethoxyphenyl)-4-methyl-4,5-dihydro-1,3-thiazol-2-amine

Structural Information

Molecular Formula
C12H16N2OS
SMILES
CCOC1=CC=C(C=C1)NC2=NC(CS2)C
InChI
InChI=1S/C12H16N2OS/c1-3-15-11-6-4-10(5-7-11)14-12-13-9(2)8-16-12/h4-7,9H,3,8H2,1-2H3,(H,13,14)
InChIKey
MXGRIMRRGLUNLL-UHFFFAOYSA-N
Compound name
N-(4-ethoxyphenyl)-4-methyl-4,5-dihydro-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

236.09833 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.10561 152.7
[M+Na]+ 259.08755 164.4
[M+NH4]+ 254.13215 161.8
[M+K]+ 275.06149 157.1
[M-H]- 235.09105 156.9
[M+Na-2H]- 257.07300 159.6
[M]+ 236.09778 156.0
[M]- 236.09888 156.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.