CID 75304

2300-15-4

Structural Information

Molecular Formula
C24H26O3
SMILES
CC(C)(C1=CC=C(C=C1)O)C2=CC(=C(C=C2)O)C(C)(C)C3=CC=C(C=C3)O
InChI
InChI=1S/C24H26O3/c1-23(2,16-5-10-19(25)11-6-16)18-9-14-22(27)21(15-18)24(3,4)17-7-12-20(26)13-8-17/h5-15,25-27H,1-4H3
InChIKey
VPVTXVHUJHGOCM-UHFFFAOYSA-N
Compound name
2,4-bis[2-(4-hydroxyphenyl)propan-2-yl]phenol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

6694
Patents

362.1882 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.195476 188.8
[M+Na]+ 385.177418 195.0
[M-H]- 361.180924 194.9
[M+NH4]+ 380.222023 199.3
[M+K]+ 401.151358 189.3
[M+H-H2O]+ 345.185460 180.9
[M+HCOO]- 407.186401 203.7
[M+CH3COO]- 421.202051 212.6
[M+Na-2H]- 383.162866 191.7
[M]+ 362.18765142 188.0
[M]- 362.18874858 188.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe