CID 3055777

72924-81-3

Structural Information

Molecular Formula
C24H24O3
SMILES
COC1=CC=C(C=C1)C(CCC(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O
InChI
InChI=1S/C24H24O3/c1-27-21-14-12-20(13-15-21)23(24(25)26)17-16-22(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-15,22-23H,16-17H2,1H3,(H,25,26)
InChIKey
UGRPZRYHSUVDMW-UHFFFAOYSA-N
Compound name
2-(4-methoxyphenyl)-5,5-diphenylpentanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

360.17255 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 361.179826 188.8
[M+Na]+ 383.161768 191.7
[M-H]- 359.165274 196.0
[M+NH4]+ 378.206373 199.3
[M+K]+ 399.135708 187.0
[M+H-H2O]+ 343.169810 179.0
[M+HCOO]- 405.170751 207.2
[M+CH3COO]- 419.186401 214.3
[M+Na-2H]- 381.147216 189.1
[M]+ 360.17200142 188.6
[M]- 360.17309858 188.6
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.