CID 2778975

4,4-dimethyloxazolidine-2-thione

Structural Information

Molecular Formula
C5H9NOS
SMILES
CC1(COC(=S)N1)C
InChI
InChI=1S/C5H9NOS/c1-5(2)3-7-4(8)6-5/h3H2,1-2H3,(H,6,8)
InChIKey
VIMMIOUDVZQBAK-UHFFFAOYSA-N
Compound name
4,4-dimethyl-1,3-oxazolidine-2-thione
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

15
Patents

131.04048 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 132.04776 126.5
[M+Na]+ 154.02970 136.5
[M+NH4]+ 149.07430 136.5
[M+K]+ 170.00364 129.7
[M-H]- 130.03320 128.1
[M+Na-2H]- 152.01515 130.8
[M]+ 131.03993 128.8
[M]- 131.04103 128.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe