CID 65133

Ethyl 4-hydroxy-3-methoxycinnamate

Structural Information

Molecular Formula
C12H14O4
SMILES
CCOC(=O)C=CC1=CC(=C(C=C1)O)OC
InChI
InChI=1S/C12H14O4/c1-3-16-12(14)7-5-9-4-6-10(13)11(8-9)15-2/h4-8,13H,3H2,1-2H3
InChIKey
ATJVZXXHKSYELS-UHFFFAOYSA-N
Compound name
ethyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

110
References

3945
Patents

222.0892 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.09648 148.8
[M+Na]+ 245.07842 160.3
[M+NH4]+ 240.12302 155.3
[M+K]+ 261.05236 154.9
[M-H]- 221.08192 149.0
[M+Na-2H]- 243.06387 153.4
[M]+ 222.08865 150.2
[M]- 222.08975 150.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe