CID 43810962

Tert-butyl 4-(iodomethyl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylate

Structural Information

Molecular Formula
C11H20INO3
SMILES
CC1(N(C(CO1)CI)C(=O)OC(C)(C)C)C
InChI
InChI=1S/C11H20INO3/c1-10(2,3)16-9(14)13-8(6-12)7-15-11(13,4)5/h8H,6-7H2,1-5H3
InChIKey
RAGBRZVZDZOFAI-UHFFFAOYSA-N
Compound name
tert-butyl 4-(iodomethyl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

341.0488 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.05608 161.5
[M+Na]+ 364.03802 162.1
[M-H]- 340.04152 157.7
[M+NH4]+ 359.08262 176.3
[M+K]+ 380.01196 168.6
[M+H-H2O]+ 324.04606 153.7
[M+HCOO]- 386.04700 174.3
[M+CH3COO]- 400.06265 197.9
[M+Na-2H]- 362.02347 152.9
[M]+ 341.04825 161.9
[M]- 341.04935 161.9
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.