CID 117561

Dtxsid50948483

Structural Information

Molecular Formula
C24H34O
SMILES
CCCCCCCCCCCCOC1=CC=CC(=C1)C2=CC=CC=C2
InChI
InChI=1S/C24H34O/c1-2-3-4-5-6-7-8-9-10-14-20-25-24-19-15-18-23(21-24)22-16-12-11-13-17-22/h11-13,15-19,21H,2-10,14,20H2,1H3
InChIKey
RXAZHCWELVFILX-UHFFFAOYSA-N
Compound name
1-dodecoxy-3-phenylbenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

338.26096 Da
Monoisotopic Mass

9.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.26824 189.0
[M+Na]+ 361.25018 192.1
[M-H]- 337.25368 193.6
[M+NH4]+ 356.29478 202.2
[M+K]+ 377.22412 186.2
[M+H-H2O]+ 321.25822 179.5
[M+HCOO]- 383.25916 210.0
[M+CH3COO]- 397.27481 215.1
[M+Na-2H]- 359.23563 190.7
[M]+ 338.26041 193.2
[M]- 338.26151 193.2
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

No patent data available for this compound.