CID 3033287

1-butyl-4,4-dimethyl-2-imidazolidinethione

Structural Information

Molecular Formula
C9H18N2S
SMILES
CCCCN1CC(NC1=S)(C)C
InChI
InChI=1S/C9H18N2S/c1-4-5-6-11-7-9(2,3)10-8(11)12/h4-7H2,1-3H3,(H,10,12)
InChIKey
YOASKFDRZFNNCF-UHFFFAOYSA-N
Compound name
1-butyl-4,4-dimethylimidazolidine-2-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

186.11906 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.12634 140.9
[M+Na]+ 209.10828 149.2
[M-H]- 185.11178 140.6
[M+NH4]+ 204.15288 162.3
[M+K]+ 225.08222 146.0
[M+H-H2O]+ 169.11632 135.8
[M+HCOO]- 231.11726 154.2
[M+CH3COO]- 245.13291 179.7
[M+Na-2H]- 207.09373 140.8
[M]+ 186.11851 140.6
[M]- 186.11961 140.6
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.