CID 73880630

Ns00044821

Structural Information

Molecular Formula
C18H24O3
SMILES
CC=C(C1=CC(=C(C=C1)C(=CC)OC)C(=CC)OC)OC
InChI
InChI=1S/C18H24O3/c1-7-16(19-4)13-10-11-14(17(8-2)20-5)15(12-13)18(9-3)21-6/h7-12H,1-6H3
InChIKey
WQWDDSFYWIODCU-UHFFFAOYSA-N
Compound name
1,2,4-tris(1-methoxyprop-1-enyl)benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

288.17255 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.179826 170.0
[M+Na]+ 311.161768 175.7
[M-H]- 287.165274 173.1
[M+NH4]+ 306.206373 186.0
[M+K]+ 327.135708 173.0
[M+H-H2O]+ 271.169810 163.4
[M+HCOO]- 333.170751 189.9
[M+CH3COO]- 347.186401 204.8
[M+Na-2H]- 309.147216 168.5
[M]+ 288.17200142 174.1
[M]- 288.17309858 174.1
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.