CID 10477119

41551-58-0

Structural Information

Molecular Formula
C23H30O7
SMILES
CC(C(C1=CC(=C(C(=C1)OC)OC)OC)O)OC2=C(C=C(C=C2OC)CC=C)OC
InChI
InChI=1S/C23H30O7/c1-8-9-15-10-17(25-3)23(18(11-15)26-4)30-14(2)21(24)16-12-19(27-5)22(29-7)20(13-16)28-6/h8,10-14,21,24H,1,9H2,2-7H3
InChIKey
KKEKLEUWEJUCRA-UHFFFAOYSA-N
Compound name
2-(2,6-dimethoxy-4-prop-2-enylphenoxy)-1-(3,4,5-trimethoxyphenyl)propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

418.19916 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 419.20644 200.2
[M+Na]+ 441.18838 211.9
[M+NH4]+ 436.23298 204.4
[M+K]+ 457.16232 206.9
[M-H]- 417.19188 201.7
[M+Na-2H]- 439.17383 203.7
[M]+ 418.19861 202.1
[M]- 418.19971 202.1
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