CID 3075564

1-methyl-5-phenyl-2-imidazolidinethione

Structural Information

Molecular Formula
C10H12N2S
SMILES
CN1C(CNC1=S)C2=CC=CC=C2
InChI
InChI=1S/C10H12N2S/c1-12-9(7-11-10(12)13)8-5-3-2-4-6-8/h2-6,9H,7H2,1H3,(H,11,13)
InChIKey
ZFOUTMOBRSLFAR-UHFFFAOYSA-N
Compound name
1-methyl-5-phenylimidazolidine-2-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
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 141.1
[M+Na]+ 215.06133 150.0
[M-H]- 191.06483 144.2
[M+NH4]+ 210.10593 160.0
[M+K]+ 231.03527 145.2
[M+H-H2O]+ 175.06937 134.4
[M+HCOO]- 237.07031 155.9
[M+CH3COO]- 251.08596 153.5
[M+Na-2H]- 213.04678 141.4
[M]+ 192.07156 138.5
[M]- 192.07266 138.5
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

patents stripe