CID 3039672

Brn 1158719

Structural Information

Molecular Formula
C14H17NO6
SMILES
CC(=O)OC1=C(C=C(C=C1OC)C(=O)N2CCOC2)OC
InChI
InChI=1S/C14H17NO6/c1-9(16)21-13-11(18-2)6-10(7-12(13)19-3)14(17)15-4-5-20-8-15/h6-7H,4-5,8H2,1-3H3
InChIKey
IAFRHQTXAQEFCH-UHFFFAOYSA-N
Compound name
[2,6-dimethoxy-4-(1,3-oxazolidine-3-carbonyl)phenyl] acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.1056 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.11288 163.8
[M+Na]+ 318.09482 170.6
[M-H]- 294.09832 170.0
[M+NH4]+ 313.13942 178.1
[M+K]+ 334.06876 171.5
[M+H-H2O]+ 278.10286 156.5
[M+HCOO]- 340.10380 183.5
[M+CH3COO]- 354.11945 200.2
[M+Na-2H]- 316.08027 164.2
[M]+ 295.10505 169.0
[M]- 295.10615 169.0
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.