CID 14523069

Tert-butyl 4-(4-methoxy-4-oxobutan-2-yl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylate

Structural Information

Molecular Formula
C15H27NO5
SMILES
CC(CC(=O)OC)C1COC(N1C(=O)OC(C)(C)C)(C)C
InChI
InChI=1S/C15H27NO5/c1-10(8-12(17)19-7)11-9-20-15(5,6)16(11)13(18)21-14(2,3)4/h10-11H,8-9H2,1-7H3
InChIKey
XZVSCLBFKZVCAY-UHFFFAOYSA-N
Compound name
tert-butyl 4-(4-methoxy-4-oxobutan-2-yl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

301.18893 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.19621 168.9
[M+Na]+ 324.17815 174.8
[M-H]- 300.18165 171.6
[M+NH4]+ 319.22275 185.8
[M+K]+ 340.15209 176.7
[M+H-H2O]+ 284.18619 164.8
[M+HCOO]- 346.18713 184.3
[M+CH3COO]- 360.20278 203.6
[M+Na-2H]- 322.16360 169.2
[M]+ 301.18838 174.5
[M]- 301.18948 174.5
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.