CID 3032606

13206-11-6

Structural Information

Molecular Formula
C11H14N2S
SMILES
CCC1(CNC(=S)N1)C2=CC=CC=C2
InChI
InChI=1S/C11H14N2S/c1-2-11(8-12-10(14)13-11)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H2,12,13,14)
InChIKey
RUJRFVXLDUKDFV-UHFFFAOYSA-N
Compound name
4-ethyl-4-phenylimidazolidine-2-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.08777 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.095046 145.1
[M+Na]+ 229.076988 153.0
[M-H]- 205.080494 146.5
[M+NH4]+ 224.121593 164.4
[M+K]+ 245.050928 147.4
[M+H-H2O]+ 189.085030 138.9
[M+HCOO]- 251.085971 158.2
[M+CH3COO]- 265.101621 156.5
[M+Na-2H]- 227.062436 146.6
[M]+ 206.08722142 141.0
[M]- 206.08831858 141.0
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.