CID 1549559

3-(2-methoxyphenyl)-2-phenylacrylic acid

Structural Information

Molecular Formula
C16H14O3
SMILES
COC1=CC=CC=C1/C=C(\C2=CC=CC=C2)/C(=O)O
InChI
InChI=1S/C16H14O3/c1-19-15-10-6-5-9-13(15)11-14(16(17)18)12-7-3-2-4-8-12/h2-11H,1H3,(H,17,18)/b14-11+
InChIKey
SJSYJHLLBBSLIH-SDNWHVSQSA-N
Compound name
(E)-3-(2-methoxyphenyl)-2-phenylprop-2-enoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

233
Patents

254.0943 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.10158 158.1
[M+Na]+ 277.08352 171.5
[M+NH4]+ 272.12812 165.6
[M+K]+ 293.05746 164.8
[M-H]- 253.08702 161.3
[M+Na-2H]- 275.06897 166.2
[M]+ 254.09375 160.8
[M]- 254.09485 160.8
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

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