CID 10584643

2-(3,4,5-trimethoxyphenyl)ethanol

Structural Information

Molecular Formula
C11H16O4
SMILES
COC1=CC(=CC(=C1OC)OC)CCO
InChI
InChI=1S/C11H16O4/c1-13-9-6-8(4-5-12)7-10(14-2)11(9)15-3/h6-7,12H,4-5H2,1-3H3
InChIKey
CMHJWVUNNCFNOH-UHFFFAOYSA-N
Compound name
2-(3,4,5-trimethoxyphenyl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

38
Patents

212.10486 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.11214 145.1
[M+Na]+ 235.09408 157.4
[M+NH4]+ 230.13868 152.4
[M+K]+ 251.06802 151.9
[M-H]- 211.09758 146.1
[M+Na-2H]- 233.07953 150.4
[M]+ 212.10431 147.1
[M]- 212.10541 147.1
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

patents stripe