CID 131753104

Myristicanol a

Structural Information

Molecular Formula
C23H30O8
SMILES
CC(C(C1=CC(=C(C(=C1)OC)OC)OC)O)OC2=C(C=C(C=C2OC)/C=C\CO)OC
InChI
InChI=1S/C23H30O8/c1-14(21(25)16-12-19(28-4)22(30-6)20(13-16)29-5)31-23-17(26-2)10-15(8-7-9-24)11-18(23)27-3/h7-8,10-14,21,24-25H,9H2,1-6H3/b8-7-
InChIKey
QHYPOKHWZKVCEW-FPLPWBNLSA-N
Compound name
2-[4-[(Z)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenoxy]-1-(3,4,5-trimethoxyphenyl)propan-1-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

17
Patents

434.19406 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 435.20134 203.7
[M+Na]+ 457.18328 214.3
[M+NH4]+ 452.22788 206.9
[M+K]+ 473.15722 210.2
[M-H]- 433.18678 204.1
[M+Na-2H]- 455.16873 206.1
[M]+ 434.19351 205.0
[M]- 434.19461 205.0
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

patents stripe