CID 3032605

4-methyl-4-phenyl-2-imidazolidinethione

Structural Information

Molecular Formula
C10H12N2S
SMILES
CC1(CNC(=S)N1)C2=CC=CC=C2
InChI
InChI=1S/C10H12N2S/c1-10(7-11-9(13)12-10)8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H2,11,12,13)
InChIKey
TVFHYGQOWWPMMJ-UHFFFAOYSA-N
Compound name
4-methyl-4-phenylimidazolidine-2-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

192.07211 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.07939 140.9
[M+Na]+ 215.06133 149.3
[M-H]- 191.06483 142.5
[M+NH4]+ 210.10593 160.8
[M+K]+ 231.03527 143.9
[M+H-H2O]+ 175.06937 134.9
[M+HCOO]- 237.07031 154.3
[M+CH3COO]- 251.08596 152.7
[M+Na-2H]- 213.04678 142.9
[M]+ 192.07156 136.4
[M]- 192.07266 136.4
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