CID 5377733

Ethyl 2,4,6-trimethoxycinnamate

Structural Information

Molecular Formula
C14H18O5
SMILES
CCOC(=O)/C=C/C1=C(C=C(C=C1OC)OC)OC
InChI
InChI=1S/C14H18O5/c1-5-19-14(15)7-6-11-12(17-3)8-10(16-2)9-13(11)18-4/h6-9H,5H2,1-4H3/b7-6+
InChIKey
NGOZXDZLACOEPS-VOTSOKGWSA-N
Compound name
ethyl (E)-3-(2,4,6-trimethoxyphenyl)prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

266.11542 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.12270 159.6
[M+Na]+ 289.10464 171.1
[M+NH4]+ 284.14924 165.5
[M+K]+ 305.07858 165.8
[M-H]- 265.10814 159.7
[M+Na-2H]- 287.09009 163.6
[M]+ 266.11487 161.0
[M]- 266.11597 161.0
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