CID 3032606

4-ethyl-4-phenyl-2-imidazolidinethione

Structural Information

Molecular Formula
C11H14N2S
SMILES
CCC1(CNC(=S)N1)C2=CC=CC=C2
InChI
InChI=1S/C11H14N2S/c1-2-11(8-12-10(14)13-11)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H2,12,13,14)
InChIKey
RUJRFVXLDUKDFV-UHFFFAOYSA-N
Compound name
4-ethyl-4-phenylimidazolidine-2-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.08777 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.09505 145.1
[M+Na]+ 229.07699 153.0
[M-H]- 205.08049 146.5
[M+NH4]+ 224.12159 164.4
[M+K]+ 245.05093 147.4
[M+H-H2O]+ 189.08503 138.9
[M+HCOO]- 251.08597 158.2
[M+CH3COO]- 265.10162 156.5
[M+Na-2H]- 227.06244 146.6
[M]+ 206.08722 141.0
[M]- 206.08832 141.0
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.