CID 23391122

3o2t

Structural Information

Molecular Formula
C23H24O
SMILES
CCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)CC
InChI
InChI=1S/C23H24O/c1-3-17-24-23-15-13-22(14-16-23)21-11-9-20(10-12-21)19-7-5-18(4-2)6-8-19/h5-16H,3-4,17H2,1-2H3
InChIKey
MBTZTTYZYXBDRU-UHFFFAOYSA-N
Compound name
1-ethyl-4-[4-(4-propoxyphenyl)phenyl]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

316.1827 Da
Monoisotopic Mass

6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.18998 178.4
[M+Na]+ 339.17192 185.1
[M-H]- 315.17542 187.7
[M+NH4]+ 334.21652 192.6
[M+K]+ 355.14586 179.1
[M+H-H2O]+ 299.17996 168.8
[M+HCOO]- 361.18090 201.1
[M+CH3COO]- 375.19655 210.3
[M+Na-2H]- 337.15737 181.7
[M]+ 316.18215 180.3
[M]- 316.18325 180.3
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