CID 119096628

1397293-43-4

Structural Information

Molecular Formula
C5H8INO2
SMILES
CC1(CNC(=O)O1)CI
InChI
InChI=1S/C5H8INO2/c1-5(2-6)3-7-4(8)9-5/h2-3H2,1H3,(H,7,8)
InChIKey
HVBDFOVRMJOTEB-UHFFFAOYSA-N
Compound name
5-(iodomethyl)-5-methyl-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.95998 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.96726 132.6
[M+Na]+ 263.94920 134.0
[M-H]- 239.95270 127.5
[M+NH4]+ 258.99380 149.9
[M+K]+ 279.92314 139.6
[M+H-H2O]+ 223.95724 124.6
[M+HCOO]- 285.95818 148.1
[M+CH3COO]- 299.97383 176.0
[M+Na-2H]- 261.93465 127.0
[M]+ 240.95943 128.7
[M]- 240.96053 128.7
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.