CID 3075569

1-ethyl-5-(4-methoxyphenyl)-2-imidazolidinethione

Structural Information

Molecular Formula
C12H16N2OS
SMILES
CCN1C(CNC1=S)C2=CC=C(C=C2)OC
InChI
InChI=1S/C12H16N2OS/c1-3-14-11(8-13-12(14)16)9-4-6-10(15-2)7-5-9/h4-7,11H,3,8H2,1-2H3,(H,13,16)
InChIKey
DEYNYNKUXGSFLP-UHFFFAOYSA-N
Compound name
1-ethyl-5-(4-methoxyphenyl)imidazolidine-2-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

236.09833 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.10561 153.2
[M+Na]+ 259.08755 161.8
[M-H]- 235.09105 156.3
[M+NH4]+ 254.13215 170.5
[M+K]+ 275.06149 157.0
[M+H-H2O]+ 219.09559 146.2
[M+HCOO]- 281.09653 167.5
[M+CH3COO]- 295.11218 187.7
[M+Na-2H]- 257.07300 151.9
[M]+ 236.09778 153.1
[M]- 236.09888 153.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe