CID 361652

Nsc624870

Structural Information

Molecular Formula
C32H28O
SMILES
CC(C)C1(C(=C(C(=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)O
InChI
InChI=1S/C32H28O/c1-23(2)32(33)30(26-19-11-5-12-20-26)28(24-15-7-3-8-16-24)29(25-17-9-4-10-18-25)31(32)27-21-13-6-14-22-27/h3-23,33H,1-2H3
InChIKey
TWKMEFMBSYSNHH-UHFFFAOYSA-N
Compound name
2,3,4,5-tetraphenyl-1-propan-2-ylcyclopenta-2,4-dien-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

428.21402 Da
Monoisotopic Mass

6.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 429.22130 210.5
[M+Na]+ 451.20324 216.7
[M-H]- 427.20674 224.7
[M+NH4]+ 446.24784 222.0
[M+K]+ 467.17718 208.2
[M+H-H2O]+ 411.21128 199.1
[M+HCOO]- 473.21222 230.5
[M+CH3COO]- 487.22787 219.3
[M+Na-2H]- 449.18869 208.9
[M]+ 428.21347 208.9
[M]- 428.21457 208.9
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.