CID 3033793

101564-83-4

Structural Information

Molecular Formula
C15H16N2OS
SMILES
CCOC1CNC(=S)N1C2=CC=CC3=CC=CC=C32
InChI
InChI=1S/C15H16N2OS/c1-2-18-14-10-16-15(19)17(14)13-9-5-7-11-6-3-4-8-12(11)13/h3-9,14H,2,10H2,1H3,(H,16,19)
InChIKey
CNCZYMNHWYFXFQ-UHFFFAOYSA-N
Compound name
5-ethoxy-1-naphthalen-1-ylimidazolidine-2-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.09833 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.10561 161.6
[M+Na]+ 295.08755 170.5
[M-H]- 271.09105 165.4
[M+NH4]+ 290.13215 178.4
[M+K]+ 311.06149 164.3
[M+H-H2O]+ 255.09559 154.4
[M+HCOO]- 317.09653 175.0
[M+CH3COO]- 331.11218 172.7
[M+Na-2H]- 293.07300 162.1
[M]+ 272.09778 161.5
[M]- 272.09888 161.5
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

No patent data available for this compound.