CID 21959416

Tert-butyl 3-[(methanesulfonyloxy)methyl]azetidine-1-carboxylate

Structural Information

Molecular Formula
C10H19NO5S
SMILES
CC(C)(C)OC(=O)N1CC(C1)COS(=O)(=O)C
InChI
InChI=1S/C10H19NO5S/c1-10(2,3)16-9(12)11-5-8(6-11)7-15-17(4,13)14/h8H,5-7H2,1-4H3
InChIKey
LVYVGVJPTGKRSM-UHFFFAOYSA-N
Compound name
tert-butyl 3-(methylsulfonyloxymethyl)azetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

557
Patents

265.0984 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.10568 155.9
[M+Na]+ 288.08762 160.1
[M-H]- 264.09112 157.5
[M+NH4]+ 283.13222 165.0
[M+K]+ 304.06156 163.0
[M+H-H2O]+ 248.09566 144.3
[M+HCOO]- 310.09660 167.5
[M+CH3COO]- 324.11225 194.9
[M+Na-2H]- 286.07307 157.5
[M]+ 265.09785 169.9
[M]- 265.09895 169.9
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

patents stripe