CID 45360337

Verimol g

Structural Information

Molecular Formula
C20H26O5
SMILES
CC(C(C1=CC=C(C=C1)OC)OC(C)C(C2=CC=C(C=C2)OC)O)O
InChI
InChI=1S/C20H26O5/c1-13(21)20(16-7-11-18(24-4)12-8-16)25-14(2)19(22)15-5-9-17(23-3)10-6-15/h5-14,19-22H,1-4H3
InChIKey
TXTILWZRXPOUKA-UHFFFAOYSA-N
Compound name
1-[1-hydroxy-1-(4-methoxyphenyl)propan-2-yl]oxy-1-(4-methoxyphenyl)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

346.178 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 347.18528 183.3
[M+Na]+ 369.16722 186.4
[M-H]- 345.17072 186.6
[M+NH4]+ 364.21182 194.5
[M+K]+ 385.14116 185.0
[M+H-H2O]+ 329.17526 175.2
[M+HCOO]- 391.17620 199.5
[M+CH3COO]- 405.19185 211.2
[M+Na-2H]- 367.15267 181.0
[M]+ 346.17745 186.2
[M]- 346.17855 186.2
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