CID 3032605

13206-10-5

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

5
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 140.9
[M+Na]+ 215.061328 149.3
[M-H]- 191.064834 142.5
[M+NH4]+ 210.105933 160.8
[M+K]+ 231.035268 143.9
[M+H-H2O]+ 175.069370 134.9
[M+HCOO]- 237.070311 154.3
[M+CH3COO]- 251.085961 152.7
[M+Na-2H]- 213.046776 142.9
[M]+ 192.07156142 136.4
[M]- 192.07265858 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