CID 3075564

186424-02-2

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

14
Patents

192.07211 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.079386 141.1
[M+Na]+ 215.061328 150.0
[M-H]- 191.064834 144.2
[M+NH4]+ 210.105933 160.0
[M+K]+ 231.035268 145.2
[M+H-H2O]+ 175.069370 134.4
[M+HCOO]- 237.070311 155.9
[M+CH3COO]- 251.085961 153.5
[M+Na-2H]- 213.046776 141.4
[M]+ 192.07156142 138.5
[M]- 192.07265858 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