CID 3039673

Brn 1176360

Structural Information

Molecular Formula
C15H17NO8
SMILES
COC1=CC(=CC(=C1CCOC(=O)O)OC)C(=O)N2CCOC2=O
InChI
InChI=1S/C15H17NO8/c1-21-11-7-9(13(17)16-4-6-23-14(16)18)8-12(22-2)10(11)3-5-24-15(19)20/h7-8H,3-6H2,1-2H3,(H,19,20)
InChIKey
UTQKWZCDSHOAAL-UHFFFAOYSA-N
Compound name
2-[2,6-dimethoxy-4-(2-oxo-1,3-oxazolidine-3-carbonyl)phenyl]ethyl hydrogen carbonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

339.09543 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.102706 171.4
[M+Na]+ 362.084648 178.0
[M-H]- 338.088154 176.4
[M+NH4]+ 357.129253 183.1
[M+K]+ 378.058588 178.7
[M+H-H2O]+ 322.092690 164.1
[M+HCOO]- 384.093631 189.8
[M+CH3COO]- 398.109281 206.1
[M+Na-2H]- 360.070096 170.8
[M]+ 339.09488142 177.7
[M]- 339.09597858 177.7
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.