CID 10987416

63881-51-6

Structural Information

Molecular Formula
C11H10O4
SMILES
CCOC(=O)C1=COC2=CC=CC=C2O1
InChI
InChI=1S/C11H10O4/c1-2-13-11(12)10-7-14-8-5-3-4-6-9(8)15-10/h3-7H,2H2,1H3
InChIKey
HYAIFRZTFJBMMC-UHFFFAOYSA-N
Compound name
ethyl 1,4-benzodioxine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

206.0579 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.06518 140.8
[M+Na]+ 229.04712 154.4
[M+NH4]+ 224.09172 149.1
[M+K]+ 245.02106 149.2
[M-H]- 205.05062 145.4
[M+Na-2H]- 227.03257 146.3
[M]+ 206.05735 144.1
[M]- 206.05845 144.1
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