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]+ 273.105606 161.6
[M+Na]+ 295.087548 170.5
[M-H]- 271.091054 165.4
[M+NH4]+ 290.132153 178.4
[M+K]+ 311.061488 164.3
[M+H-H2O]+ 255.095590 154.4
[M+HCOO]- 317.096531 175.0
[M+CH3COO]- 331.112181 172.7
[M+Na-2H]- 293.072996 162.1
[M]+ 272.09778142 161.5
[M]- 272.09887858 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.