CID 3075575

186424-13-5

Structural Information

Molecular Formula
C12H16N2S
SMILES
CCN1C(CNC1=S)C2=CC=C(C=C2)C
InChI
InChI=1S/C12H16N2S/c1-3-14-11(8-13-12(14)15)10-6-4-9(2)5-7-10/h4-7,11H,3,8H2,1-2H3,(H,13,15)
InChIKey
YDXUEDMPRVGCRM-UHFFFAOYSA-N
Compound name
1-ethyl-5-(4-methylphenyl)imidazolidine-2-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

220.10342 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.11070 149.7
[M+Na]+ 243.09264 158.5
[M-H]- 219.09614 152.8
[M+NH4]+ 238.13724 167.8
[M+K]+ 259.06658 153.2
[M+H-H2O]+ 203.10068 142.9
[M+HCOO]- 265.10162 163.8
[M+CH3COO]- 279.11727 161.5
[M+Na-2H]- 241.07809 148.3
[M]+ 220.10287 148.2
[M]- 220.10397 148.2
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.