CID 13337413

88770-75-6

Structural Information

Molecular Formula
C26H37NO7
SMILES
COC1=C(C(=C(C(=C1OC)OC)OC)OCCN2CCCCC2)C(CCC3=CC=C(C=C3)O)O
InChI
InChI=1S/C26H37NO7/c1-30-22-21(20(29)13-10-18-8-11-19(28)12-9-18)23(25(32-3)26(33-4)24(22)31-2)34-17-16-27-14-6-5-7-15-27/h8-9,11-12,20,28-29H,5-7,10,13-17H2,1-4H3
InChIKey
ZBTWEJSMDPMTJR-UHFFFAOYSA-N
Compound name
4-[3-hydroxy-3-[2,3,4,5-tetramethoxy-6-(2-piperidin-1-ylethoxy)phenyl]propyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

475.257 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 476.26428 218.1
[M+Na]+ 498.24622 228.7
[M+NH4]+ 493.29082 221.9
[M+K]+ 514.22016 223.0
[M-H]- 474.24972 220.8
[M+Na-2H]- 496.23167 221.6
[M]+ 475.25645 220.1
[M]- 475.25755 220.1
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

No patent data available for this compound.