CID 6446799

Brn 2285579

Structural Information

Molecular Formula
C15H22O4
SMILES
CC(C)C(/C=C/C1=CC(=C(C(=C1)OC)OC)OC)O
InChI
InChI=1S/C15H22O4/c1-10(2)12(16)7-6-11-8-13(17-3)15(19-5)14(9-11)18-4/h6-10,12,16H,1-5H3/b7-6+
InChIKey
SJWYLBIDXWSXKG-VOTSOKGWSA-N
Compound name
(E)-4-methyl-1-(3,4,5-trimethoxyphenyl)pent-1-en-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

266.1518 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.15908 162.4
[M+Na]+ 289.14102 173.2
[M+NH4]+ 284.18562 168.5
[M+K]+ 305.11496 168.3
[M-H]- 265.14452 162.5
[M+Na-2H]- 287.12647 165.7
[M]+ 266.15125 163.8
[M]- 266.15235 163.8
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.